Accuracy
chloropentafluorobenzene
1732 Chloropentafluorobenzene
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Geometry predicted using PM7
ΔHf: -193.5 kcal/mol, REF: NIST Chemistry WebBook, NIST Standard Reference Database, No. 69; W. G. Mallard, P. J. Linstrom, Eds., National Institute of Standards and Technology, Gaithersberg, http://webbook.nist.gov/chemistry.
Chloropentafluorobenzene
H=-193.5 HR=NIST
C 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
C 1.39418458 +1 0.0000000 +0 0.0000000 +0 1 0 0
C 1.39431134 +1 119.3281728 +1 0.0000000 +0 2 1 0
C 1.39861136 +1 120.6364479 +1 -0.0362025 +1 3 2 1
C 1.39834711 +1 119.7694872 +1 -0.0140233 +1 4 3 2
C 1.39823769 +1 119.8671528 +1 0.0124525 +1 5 4 3
F 1.31692833 +1 119.9347520 +1 -179.9745064 +1 1 2 3
Cl 1.68205781 +1 120.3839533 +1 179.9772851 +1 2 1 3
F 1.31701065 +1 119.9008282 +1 -179.9967532 +1 3 2 4
F 1.31662552 +1 120.1403783 +1 -179.9999493 +1 4 3 5
F 1.31574383 +1 120.0801283 +1 179.9983787 +1 5 4 6
F 1.31670288 +1 120.0816196 +1 -179.9903327 +1 6 5 4