PM7 Accuracy
Date:Mon Feb 11 04:20:05 2019
propyltrimethyltin
5504 Propyltrimethyltin
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ΔHf: -11.2 kcal/mol, REF: G. M. Kolyakova, I. B. Rabinovich, E. N Zoria, Dokl. Akad. Nauk SSSR, 209, 616 (1973).
PM7
Propyltrimethyltin
H=-11.2 HR=KRZ1973
C 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
Sn 2.14002982 +1 0.0000000 +0 0.0000000 +0 1 0 0
C 2.14007894 +1 109.6283043 +1 0.0000000 +0 2 1 0
H 1.08792541 +1 111.1467489 +1 155.5025768 +1 3 2 1
C 2.14003613 +1 109.5925753 +1 35.1473452 +1 2 3 4
C 2.16052183 +1 109.9279219 +1 -83.6084390 +1 2 3 4
H 1.08786178 +1 111.1512993 +1 35.3884376 +1 3 2 1
H 1.08826786 +1 110.9442083 +1 -84.5621490 +1 3 2 1
H 1.08794435 +1 111.1204487 +1 -158.1335763 +1 1 2 3
H 1.08826100 +1 110.9487272 +1 81.9707250 +1 1 2 3
H 1.08782091 +1 111.1799726 +1 -38.0100437 +1 1 2 3
H 1.08830464 +1 110.9538136 +1 -178.8536959 +1 5 2 6
H 1.08797349 +1 111.2059445 +1 61.2369783 +1 5 2 6
H 1.08792680 +1 111.2220203 +1 -58.9366089 +1 5 2 6
C 1.52838877 +1 116.4648171 +1 179.0420348 +1 6 2 5
H 1.10089871 +1 107.5352458 +1 55.7358099 +1 6 2 5
H 1.10091178 +1 107.5381685 +1 -57.6501968 +1 6 2 5
C 1.53621800 +1 110.6919047 +1 -179.9983945 +1 15 6 2
H 1.10699700 +1 110.9816418 +1 58.9213386 +1 15 6 2
H 1.10702504 +1 110.9695287 +1 -58.9164784 +1 15 6 2
H 1.09395955 +1 111.3344741 +1 179.9179000 +1 18 15 6
H 1.09456651 +1 111.2110559 +1 59.7939560 +1 18 15 6
H 1.09456599 +1 111.2145980 +1 -59.9523325 +1 18 15 6