Geometry & MOs

Info

ID:	228413
PubChem CID:	87564303
Reduced:	SCl3N3O3H16C17 (1)
Stoich.:	AB3C3D3E16F17 (1)
Weight, g/mol:	365.11764
ΔH_f, kcal/mol:	-109.5
Dipole, Da:	6.36
IP(EA), eV:	-8.6(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cobalt;(5Z,9Z,14Z)-2,3,7,8,12,13,17,18,19,22-decahydro-1H-corrin

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1Cl)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)N)Cl.Cl

DOS

IR

Vibrations