Accuracy
perfluoro 3-ethyl 2,4 dimethyl pent-2-en
1366 Perfluoro 3-ethyl 2,4 dimethyl pent-2-en
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Geometry predicted using PM7
ΔHf: -897.1 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.
Perfluoro 3-ethyl 2,4 dimethyl pent-2-en
H=-897.06 HR=NIST
C 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
C 1.52509454 +1 0.0000000 +0 0.0000000 +0 1 0 0
C 1.33735584 +1 123.1150868 +1 0.0000000 +0 2 1 0
C 1.51348636 +1 126.6129968 +1 -176.0897792 +1 3 2 1
C 1.57407359 +1 114.3573938 +1 49.7428031 +1 4 3 2
C 1.52863543 +1 121.2843413 +1 3.9627755 +1 3 2 1
C 1.57672819 +1 112.4800616 +1 -94.0444350 +1 6 3 2
C 1.51899870 +1 109.7267201 +1 179.9269181 +1 2 1 3
C 1.57164240 +1 110.5018690 +1 -80.2706741 +1 4 3 2
F 1.32872553 +1 113.4436926 +1 160.8565031 +1 1 2 3
F 1.32974932 +1 113.2476814 +1 41.8207780 +1 1 2 3
F 1.32801155 +1 112.7803519 +1 -79.1679826 +1 1 2 3
F 1.35084615 +1 109.2093504 +1 165.0360676 +1 4 3 2
F 1.32601344 +1 111.2807797 +1 123.8499636 +1 5 4 3
F 1.32677457 +1 112.6711702 +1 5.3893185 +1 5 4 3
F 1.32388133 +1 114.2044923 +1 -116.3190716 +1 5 4 3
F 1.33605794 +1 111.3456678 +1 143.2034482 +1 6 3 2
F 1.33459492 +1 112.1319398 +1 29.6928885 +1 6 3 2
F 1.32335221 +1 112.6375392 +1 143.0414209 +1 7 6 3
F 1.32737443 +1 112.0550575 +1 22.8802546 +1 7 6 3
F 1.32496597 +1 112.1694634 +1 -96.4212482 +1 7 6 3
F 1.32735347 +1 115.4319809 +1 -167.0243687 +1 8 2 1
F 1.32868521 +1 112.4826921 +1 71.9808104 +1 8 2 1
F 1.32971557 +1 111.9942539 +1 -47.4088592 +1 8 2 1
F 1.32385224 +1 113.1714119 +1 161.4086106 +1 9 4 3
F 1.32543933 +1 113.5086416 +1 39.5294138 +1 9 4 3
F 1.32670749 +1 110.9321137 +1 -79.2710052 +1 9 4 3