PM7 Accuracy
Date:Mon Feb 11 04:20:05 2019
methylmercuric cyanide
7896 Methylmercuric cyanide
(Previous)
(Back)
(Next)
Dipole: 4.7 Debye, REF: C. A. Rego, P. A. Cox, J. Chem. Phys., 89, 124 (1988).
PM7
Methylmercuric cyanide
D=4.69 DR=RC1988
Hg 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
C 2.06349430 +1 0.0000000 +0 0.0000000 +0 1 0 0
C 1.95066221 +1 180.0000000 +0 0.0000000 +0 1 2 0
H 1.09768387 +1 111.6692339 +1 0.0000000 +0 2 1 3
H 1.09769267 +1 111.6717505 +1 119.9799141 +1 2 1 4
H 1.09768652 +1 111.6941079 +1 -120.0110768 +1 2 1 4
N 1.15610946 +1 179.9998877 +1 3.1085139 +1 3 2 6