Geometry & MOs

Info

ID:	244083
PubChem CID:	99313630
Reduced:	SN3O3C18H21 (1)
Stoich.:	AB3C3D18E21 (1)
Weight, g/mol:	386.120132
ΔH_f, kcal/mol:	-87.0
Dipole, Da:	4.79
IP(EA), eV:	-8.59(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-phenyl-N-[3-(pyridin-2-ylsulfanylmethyl)phenyl]imidazole-4-carboxamide

Drug info:

PubChemData

Smile

CCOC(=O)N(C)CC(=O)NC1=CC=CC(=C1)CSC2=CC=CC=N2

DOS

IR

Vibrations