C26H34O2-1

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6,6'-Bis(3-oxadiamantane)

Experimental GED+MW re structure <bib id="FokinJACS2017" /> of syn conformer at 583 K:

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62 Exp GED+MW re syn C 0.800759100018 -0.156554539344 0.299573039944 C -0.800759541130 0.156563253744 0.299573648300 C 1.475606997620 -0.618696001448 -1.033068670513 C 2.939566901169 -1.063057997968 -0.780825784392 C 3.768411807433 0.137166326557 -0.312380055046 C 3.129148121205 0.605733287528 0.990592598874 C 1.677235472051 1.059696770492 0.739216011974 C 1.035005713560 -1.236368339180 1.379103554868 C 1.552886672993 0.482133529467 -2.104983849942 C 3.049516349695 -2.140979202425 0.286672129660 C 3.775408323809 1.262575333422 -1.334365230199 O 3.210220364308 -0.409566647086 1.973592931415 C 1.709913486441 2.182774150092 -0.299713149505 C 2.497720665824 -1.572138373428 1.584384752104 C 2.338719799990 1.686061881134 -1.598549293185 C -1.475607618050 0.618693310312 -1.033074902848 C -2.939573286573 1.063048225131 -0.780833940938 C -3.768410294491 -0.137175265534 -0.312385106236 C -3.129151684852 -0.605733630541 0.990598869310 C -1.677233631467 -1.059686198397 0.739218042642 C -1.035009923809 1.236385492157 1.379087579380 C -1.552882698060 -0.482143168678 -2.104980790275 C -3.049528844622 2.140975506880 0.286652042916 C -3.775400737835 -1.262595132998 -1.334356911225 O -3.210222303468 0.409578021564 1.973585314440 C -1.709903291018 -2.182773322049 -0.299697300199 C -2.497729459802 1.572154167932 1.584377946261 C -2.338707198744 -1.686072920014 -1.598540089928 H 0.945160162299 -1.489061132662 -1.438597075891 H 3.338625280478 -1.440651082508 -1.733378693594 H 4.798618606518 -0.186329309816 -0.108448348099 H 3.688410834088 1.459697472729 1.398708989210 H 1.321030828535 1.457145936307 1.694106333444 H 0.612540511213 -0.903617308667 2.335118286632 H 0.530457344364 -2.172316944454 1.119759317325 H 2.046806708684 0.065657365463 -2.994217955772 H 0.572232041027 0.813537331159 -2.442314802085 H 2.476593793175 -3.035812822243 0.010860724337 H 4.094341014312 -2.452252936599 0.407897390762 H 4.370173886923 2.108976103597 -0.964772035917 H 4.252607582831 0.924896673377 -2.263706910872 H 0.702248931774 2.569756805144 -0.489927675052 H 2.288074581686 3.029244617842 0.096247721004 H 2.600714789288 -2.285932524956 2.410683798566 H 2.313638940368 2.483828518853 -2.351583906801 H -0.945167686374 1.489059655862 -1.438605301981 H -3.338632479065 1.440630802530 -1.733394634396 H -4.798616505295 0.186327277312 -0.108453355678 H -3.688407443104 -1.459690775035 1.398715802778 H -1.321031290443 -1.457127993847 1.694119112010 H -0.612545192606 0.903644711082 2.335109057983 H -0.530468206992 2.172333678634 1.119735847143 H -2.046802953327 -0.065675214248 -2.994218278540 H -0.572223504354 -0.813542667329 -2.442308836630 H -2.476616627909 3.035811955844 0.010834963502 H -4.094357683835 2.452238319878 0.407882815682 H -4.370161190146 -2.108994735679 -0.964761611640 H -4.252598406203 -0.924922759160 -2.263703404977 H -0.702232090060 -2.569745403676 -0.489910303158 H -2.288053499285 -3.029246050651 0.096265900252 H -2.600723007981 2.285949158590 2.410661818809 H -2.313621599033 -2.483844155913 -2.351567600163

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Experimental GED+MW re structure <bib id="FokinJACS2017" /> of anti conformer at 583 K:

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62 Exp GED+MW re anti C -0.802445000544 -0.151348555212 0.313673990192 C 0.802445038314 0.151348571320 0.313673923113 C -1.677555297831 1.068947328097 0.768906900253 C -3.144380555398 0.653515934210 1.026231135282 C -3.773371505759 0.167005774441 -0.278095288242 C -2.935034853117 -1.031669296832 -0.727359435591 C -1.479808017951 -0.594011866882 -1.017629304765 C -1.034554584375 -1.290147290120 1.330687471348 C -1.700394891155 2.195179371165 -0.270209042593 C -3.256030518427 -0.465575224086 2.046812360125 C -3.782081956191 1.281344137517 -1.311155188975 O -3.014759210833 -2.063110963677 0.240855177338 C -1.572793488525 0.507188128023 -2.085797440664 C -2.494221439064 -1.658120699402 1.498887318808 C -2.346297247216 1.711330847899 -1.566863492266 C 1.677555365476 -1.068947268623 0.768906891992 C 3.144380639931 -0.653515850222 1.026230991185 C 3.773371504694 -0.167005814706 -0.278095519964 C 2.935034822568 1.031669213769 -0.727359726484 C 1.479807968353 0.594011756167 -1.017629458465 C 1.034554688888 1.290147403110 1.330687280552 C 1.700394890607 -2.195179410679 -0.270208945066 C 3.256030669936 0.465575405296 2.046812102094 C 3.782081887330 -1.281344276193 -1.311155315114 O 3.014759243825 2.063110972848 0.240854782956 C 1.572793368828 -0.507188340493 -2.085797495564 C 2.494221554615 1.658120828416 1.498886997167 C 2.346297161574 -1.711331010935 -1.566863483220 H -1.305771766882 1.462198674365 1.720287065101 H -3.681535365338 1.543390192061 1.386136280925 H -4.800584611769 -0.175142742374 -0.090059195018 H -3.352263024403 -1.459992863176 -1.649421532747 H -0.962237350866 -1.466840221331 -1.433443422253 H -0.507989922548 -2.195821926323 1.019269720035 H -0.633963793772 -1.011007904848 2.314417766229 H -2.265766502763 3.045904356461 0.134447071572 H -0.692623135940 2.573131646982 -0.475267511571 H -2.826002114138 -0.173414993366 3.013397495323 H -4.308757042643 -0.717835757813 2.224268658143 H -4.247782571902 0.941279452795 -2.245778697790 H -4.387696287170 2.120772259308 -0.944352398084 H -0.593591322169 0.833120551651 -2.432215690629 H -2.077690070459 0.095312258005 -2.971443362081 H -2.581933366107 -2.529425621724 2.159425318010 H -2.320635841315 2.513779209803 -2.314619881811 H 1.305771896963 -1.462198524260 1.720287118700 H 3.681535473489 -1.543390073788 1.386136186347 H 4.800581398105 0.175145304673 -0.090046612871 H 3.352262933343 1.459992692276 -1.649421891824 H 0.962237273980 1.466840071005 -1.433443625134 H 0.507990006623 2.195822009648 1.019269477519 H 0.633963962843 1.011008111551 2.314417628315 H 2.265766528771 -3.045904357426 0.134447213038 H 0.692623121936 -2.573131706030 -0.475267311904 H 2.826002329079 0.173415266654 3.013397293344 H 4.308757205798 0.717835955928 2.224268306995 H 4.247782441706 -0.941279680505 -2.245778886886 H 4.387696242381 -2.120772363042 -0.944352484001 H 0.593591179738 -0.833120797121 -2.432215650220 H 2.077689892640 -0.095312554843 -2.971443489351 H 2.581933525006 2.529425813661 2.159424907610 H 2.320635706601 -2.513779444072 -2.314619794638

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