Accuracy
tetramethylthiourea
2119 Tetramethylthiourea
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Geometry predicted using PM7
ΔHf: 5.5 kcal/mol, REF: NIST Chemistry WebBook, NIST Standard Reference Database, No. 69; W. G. Mallard, P. J. Linstrom, Eds., National Institute of Standards and Technology, Gaithersberg, http://webbook.nist.gov/chemistry.
PM7
Tetramethylthiourea
H=5.47 HR=NIST
C 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
N 1.38148879 +1 0.0000000 +0 0.0000000 +0 1 0 0
C 1.47157230 +1 120.8082671 +1 0.0000000 +0 2 1 0
C 1.47121419 +1 118.8815619 +1 -148.6641888 +1 2 1 3
N 1.38032042 +1 117.3742321 +1 -36.5305742 +1 1 2 3
C 1.47131607 +1 120.9580261 +1 -35.4287680 +1 5 1 2
C 1.47106757 +1 118.9992083 +1 -149.3733302 +1 5 1 6
S 1.69478542 +1 121.3699655 +1 -179.9922533 +1 1 2 5
H 1.10399143 +1 112.2333392 +1 -3.3976467 +1 3 2 1
H 1.10395810 +1 109.6954302 +1 121.0651983 +1 3 2 9
H 1.10526966 +1 111.1580029 +1 119.7373443 +1 3 2 10
H 1.10820835 +1 110.5161986 +1 -50.7706454 +1 4 2 1
H 1.10540823 +1 112.7511119 +1 120.7706264 +1 4 2 12
H 1.10305740 +1 109.3543485 +1 121.4919802 +1 4 2 13
H 1.10417812 +1 109.6966174 +1 116.7766415 +1 6 5 1
H 1.10413949 +1 112.2097509 +1 -120.9941428 +1 6 5 15
H 1.10502104 +1 111.1814084 +1 -119.2664223 +1 6 5 16
H 1.10825070 +1 110.5279545 +1 -50.9770257 +1 7 5 1
H 1.10547912 +1 112.7029154 +1 120.7932577 +1 7 5 18
H 1.10306932 +1 109.4096198 +1 121.4640254 +1 7 5 19