PM7 Accuracy
Date:Mon Feb 11 04:20:05 2019
diisopropylmercury
7893 Diisopropylmercury
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ΔHf: 9.7 kcal/mol, REF: J. O. Cox, G. Pilcher, "Thermochemistry of Organic and Organometallic Compounds," Academic Press, New York, N.Y., 1970.
PM7
Diisopropylmercury
H=9.7 HR=C&P1970
C 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
C 1.53083667 +1 0.0000000 +0 0.0000000 +0 1 0 0
Hg 2.10644627 +1 111.9141474 +1 0.0000000 +0 2 1 0
C 2.10659880 +1 180.0000000 +0 177.1976060 +1 3 2 1
C 1.53068233 +1 111.9330654 +1 -7.1834835 +1 4 3 1
H 1.09916802 +1 110.2280331 +1 -179.1820477 +1 5 4 3
H 1.09633109 +1 112.7592305 +1 62.1119926 +1 5 4 3
H 1.09587768 +1 112.7486914 +1 -60.4072357 +1 5 4 3
H 1.11821990 +1 106.8565728 +1 -142.5928520 +1 4 3 7
C 1.53110940 +1 111.8219821 +1 99.1460674 +1 4 3 7
H 1.11852020 +1 106.8248848 +1 135.2387442 +1 2 3 7
C 1.53072814 +1 111.9408653 +1 -106.4515060 +1 2 3 7
H 1.09904397 +1 110.2310630 +1 178.3544283 +1 1 2 3
H 1.09596903 +1 112.7777438 +1 59.5888263 +1 1 2 3
H 1.09615931 +1 112.7811394 +1 -62.8798054 +1 1 2 3
H 1.09903175 +1 110.2371741 +1 178.0043467 +1 10 4 3
H 1.09597215 +1 112.7933137 +1 59.2362219 +1 10 4 3
H 1.09614541 +1 112.7524287 +1 -63.2221058 +1 10 4 3
H 1.09905899 +1 110.2343463 +1 -178.7606355 +1 12 2 3
H 1.09614288 +1 112.7964133 +1 62.4731862 +1 12 2 3
H 1.09598876 +1 112.7563595 +1 -60.0003486 +1 12 2 3