Geometry & MOs

Info

ID:	145565
PubChem CID:	53545440
Reduced:	O2N4C15H16 (1)
Stoich.:	A2B4C15D16 (1)
Weight, g/mol:	348.104482
ΔH_f, kcal/mol:	-34.17
Dipole, Da:	5.02
IP(EA), eV:	-9.47(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1H-indol-2-ylmethyl)-3-phenyl-2-sulfanylidene-1H-imidazole-4-carboxamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CC(C(=O)N)NC(=O)NC2=CC=NC=C2

DOS

IR

Vibrations