PM7 Accuracy
Date:Mon Feb 11 04:20:05 2019
e-1-iodo-1-propene
5825 E-1-Iodo-1-propene
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ΔHf: 22.3 kcal/mol, REF: J. B. Pedley, B. S. Iseard, "CATCH Tables of Silicon Compounds," University of Sussex, 1972
SYMMETRY PM7
E-1-Iodo-1-propene
HR=CATCH H=22.26
C 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
C 1.33186516 +1 0.0000000 +0 0.0000000 +0 1 0 0
C 1.48871005 +1 121.6923144 +1 0.0000000 +0 2 1 0
XX 5.00000000 +0 127.1457417 +1 180.0000000 +0 3 2 1
H 1.09876916 +1 113.4395655 +1 0.0000000 +0 3 2 1
H 1.10157898 +1 53.4578705 +1 90.0000000 +0 3 4 5
H 1.10157898 +0 53.4578705 +0 -90.0000000 +0 3 4 5
H 1.09181292 +1 123.7007084 +1 180.0000000 +0 2 1 3
I 2.10254203 +1 122.4497970 +1 180.0000000 +0 1 2 3
H 1.08036314 +1 125.6921379 +1 0.0000000 +0 1 2 3