Geometry & MOs

Info

ID:	13921
PubChem CID:	400028
Reduced:	O2N4H16C23 (1)
Stoich.:	A2B4C16D23 (1)
Weight, g/mol:	380.127326
ΔH_f, kcal/mol:	58.05
Dipole, Da:	7.53
IP(EA), eV:	-9.24(-1.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[3-(1H-benzimidazol-2-yl)chromen-2-ylidene]amino]benzamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=C(C(=NC3=CC=C(C=C3)C(=O)N)O2)C4=NC5=CC=CC=C5N4

DOS

IR

Vibrations