Geometry & MOs

Info

ID:	290769
PubChem CID:	110508837
Reduced:	ClO2N3C16H16 (1)
Stoich.:	AB2C3D16E16 (1)
Weight, g/mol:	368.130697
ΔH_f, kcal/mol:	-15.88
Dipole, Da:	5.45
IP(EA), eV:	-8.67(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(Z)-[4-(2-methylpropoxy)phenyl]methylideneamino]-2-sulfanylidene-1,3-dihydrobenzimidazole-5-carboxamide

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1)/C=N/NC(=O)NC2=CC=CC=C2)Cl

DOS

IR

Vibrations