Accuracy
n-methylsuccinimide
1233 N-Methylsuccinimide
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Geometry predicted using PM7
ΔHf: -93.1 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
N-Methylsuccinimide
H=-93.1 HR=NIST
N 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
C 1.40743593 +1 0.0000000 +0 0.0000000 +0 1 0 0
C 1.51954609 +1 108.0553637 +1 0.0000000 +0 2 1 0
C 1.53704371 +1 105.4714810 +1 0.0475789 +1 3 2 1
C 1.40819485 +1 112.9475144 +1 -0.0169245 +1 1 2 3
C 1.45631298 +1 123.8987731 +1 179.9471292 +1 1 2 5
O 1.20065470 +1 123.7967913 +1 179.9926783 +1 2 1 3
O 1.20038511 +1 123.6894451 +1 179.9803662 +1 5 1 2
H 1.10628644 +1 110.2765868 +1 -121.8334030 +1 3 2 4
H 1.10633975 +1 110.2890611 +1 -116.3518547 +1 3 2 9
H 1.10627667 +1 112.5504280 +1 -120.4229921 +1 4 3 2
H 1.10634596 +1 112.5477847 +1 -119.3046305 +1 4 3 11
H 1.10583429 +1 110.5438580 +1 120.6566460 +1 6 1 2
H 1.10581269 +1 110.5486572 +1 119.6053267 +1 6 1 13
H 1.10695112 +1 110.3609480 +1 120.1872780 +1 6 1 14