C3F6O-1

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Perfluoropropanoyl Fluoride

Experimental GED re structure <bib id="MartinezJPCA2016" />.


Gauche-conformer (85 <math>\pm</math> 10 % @ 279 K)

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10 gauche F -1.796102555095 1.221210736129 -0.429179682463 C -1.495301219876 0.094616964300 0.198868399951 C -0.178897798408 -0.496921256133 -0.327874986265 C 1.057983829590 0.255303944536 0.203499563482 O -2.141811809675 -0.394083914337 1.054002963376 F -0.093791986394 -1.760760582282 0.071573894995 F -0.162902468800 -0.445816339140 -1.662079072305 F 2.154500195318 -0.345843832837 -0.207013513433 F 1.031492821383 0.255573078069 1.525754747403 F 1.059234528838 1.500269612945 -0.233482438840

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Anti-conformer (15 <math>\pm</math> 10 % @ 279 K)

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10 anti F -2.558191317004 0.151943256430 0.000000000000 C -1.406543832824 -0.502373920496 0.000000000000 C -0.240045432954 0.491787175002 0.000000000000 C 1.139755723549 -0.191194515552 0.000000000000 O -1.302247747258 -1.677288023925 0.000000000000 F -0.328623318845 1.260136479247 -1.088351419737 F -0.328623318845 1.260136479247 1.088351419737 F 2.077586455112 0.737700728919 0.000000000000 F 1.277178537083 -0.935171307074 -1.079857202719 F 1.277178537083 -0.935171307074 1.079857202719

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