Geometry & MOs

Info

ID:	79780
PubChem CID:	49830338
Reduced:	ClON4H13C19 (1)
Stoich.:	ABC4D13E19 (1)
Weight, g/mol:	187.074562
ΔH_f, kcal/mol:	59.29
Dipole, Da:	2.9
IP(EA), eV:	-9.05(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1H-imidazol-2-yl)benzamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=O)NC2=NC(=CC(=C2)C3=CNC4=C3C=CC=N4)Cl

DOS

IR

Vibrations