Accuracy
geme3-snme3
5583 GeMe3-SnMe3
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Geometry predicted using PM7
ΔHf: -39.7 kcal/mol, REF: J. C. Baldwin, M. F. Lappert, J. B. Pedley, J. S. Poland, J. Chem. Soc., Dalton Trans., 1943 (1972).
I.P.: 8.2 eV, REF: J. C. Baldwin, M. F. Lappert, J. B. Pedley, J. S. Poland, J. Chem. Soc., Dalton Trans., 1943 (1972).
PM7
GeMe3-SnMe3
H=-39.7 I=8.2 HR=BLPP1972 IR=BLPP1972
Ge 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
Sn 2.51024145 +1 0.0000000 +0 0.0000000 +0 1 0 0
C 1.95222980 +1 111.4968861 +1 0.0000000 +0 1 2 0
C 2.13156004 +1 106.0777597 +1 -60.9000494 +1 2 1 3
C 1.95193629 +1 111.6204807 +1 120.0513529 +1 1 2 3
C 1.95228519 +1 111.5734572 +1 -119.9232790 +1 1 2 3
C 2.13131693 +1 105.9087064 +1 59.0675625 +1 2 1 3
C 2.13121861 +1 106.0459667 +1 179.0405823 +1 2 1 3
H 1.08748075 +1 108.3550979 +1 179.3043408 +1 3 1 2
H 1.08575951 +1 110.4779793 +1 60.0981023 +1 3 1 2
H 1.08597557 +1 110.3646066 +1 -61.5538785 +1 3 1 2
H 1.08982653 +1 110.7353224 +1 157.6478396 +1 4 2 1
H 1.09001567 +1 111.7375838 +1 37.7915472 +1 4 2 1
H 1.08956938 +1 111.4036265 +1 -82.3860368 +1 4 2 1
H 1.08749527 +1 108.3639331 +1 179.7363356 +1 5 1 2
H 1.08582682 +1 110.4288300 +1 60.5459148 +1 5 1 2
H 1.08592607 +1 110.4194777 +1 -61.0762359 +1 5 1 2
H 1.08748064 +1 108.3558514 +1 175.6021235 +1 6 1 2
H 1.08570675 +1 110.6158424 +1 56.2859528 +1 6 1 2
H 1.08601942 +1 110.2208559 +1 -65.3559143 +1 6 1 2
H 1.08982345 +1 111.5903511 +1 57.1198058 +1 7 2 1
H 1.08982876 +1 111.5249088 +1 -63.0554621 +1 7 2 1
H 1.08981101 +1 110.7191125 +1 177.0197589 +1 7 2 1
H 1.08988248 +1 110.6754430 +1 175.6205798 +1 8 2 1
H 1.08977276 +1 111.5561444 +1 -64.4723114 +1 8 2 1
H 1.08978789 +1 111.6129456 +1 55.7248515 +1 8 2 1