PM7 Accuracy
Date:Mon Feb 11 04:20:05 2019
triethylbismuth
8169 Triethylbismuth
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ΔHf: 51.6 kcal/mol, REF: J. O. Cox, G. Pilcher, "Thermochemistry of Organic and Organometallic Compounds," Academic Press, New York, N.Y., 1970.
PM7
Triethylbismuth
H=51.6 HR=C&P1970
Bi 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
C 2.33490346 +1 0.0000000 +0 0.0000000 +0 1 0 0
C 2.33163311 +1 94.1365417 +1 0.0000000 +0 1 2 0
C 2.33377241 +1 95.4980261 +1 -95.3110588 +1 1 2 3
C 1.51394584 +1 112.3902941 +1 -154.7020633 +1 2 1 3
C 1.51403069 +1 112.8301058 +1 173.9552967 +1 3 1 2
C 1.51361167 +1 112.9258227 +1 -79.5023506 +1 4 1 2
H 1.09552023 +1 106.4766255 +1 -122.6281399 +1 2 1 5
H 1.09528703 +1 105.7290706 +1 -115.0159575 +1 2 1 8
H 1.09568743 +1 105.1731268 +1 -122.0962948 +1 3 1 6
H 1.09561262 +1 106.7443680 +1 -114.8002046 +1 3 1 10
H 1.09578386 +1 104.8004185 +1 -122.1457643 +1 4 1 7
H 1.09550567 +1 106.7172799 +1 -114.6926232 +1 4 1 12
H 1.09695444 +1 113.0422059 +1 60.4062948 +1 5 2 1
H 1.10112556 +1 110.2866433 +1 118.8435114 +1 5 2 14
H 1.09736204 +1 112.8337984 +1 118.6242604 +1 5 2 15
H 1.10100370 +1 110.3050035 +1 -178.5251260 +1 6 3 1
H 1.09723375 +1 112.8295355 +1 -118.6987052 +1 6 3 17
H 1.09698556 +1 113.0425689 +1 -122.4993793 +1 6 3 18
H 1.09679148 +1 113.0905266 +1 -59.5932820 +1 7 4 1
H 1.09781875 +1 112.6510310 +1 122.2615407 +1 7 4 20
H 1.10079841 +1 110.3648512 +1 118.7055847 +1 7 4 21