Geometry & MOs

Info

ID:	21462
PubChem CID:	588423
Reduced:	ClON3H12C16 (1)
Stoich.:	ABC3D12E16 (1)
Weight, g/mol:	297.06689
ΔH_f, kcal/mol:	50.02
Dipole, Da:	4.68
IP(EA), eV:	-8.5(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-(1H-indol-3-ylmethylideneamino)benzamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=CN2)C=NNC(=O)C3=CC=C(C=C3)Cl

DOS

IR

Vibrations