Geometry & MOs

Info

ID:	16126
PubChem CID:	460048
Reduced:	O3N4H18C22 (1)
Stoich.:	A3B4C18D22 (1)
Weight, g/mol:	386.13789
ΔH_f, kcal/mol:	12.44
Dipole, Da:	6.22
IP(EA), eV:	-8.69(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1H-benzimidazol-2-yl)-N-[(4-hydroxy-3-methoxyphenyl)methylideneamino]benzamide

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)C=NNC(=O)C2=CC=CC=C2C3=NC4=CC=CC=C4N3)O

DOS

IR

Vibrations