Geometry & MOs

Info

ID:	7117
PubChem CID:	71263
Reduced:	N4C13H16 (1)
Stoich.:	A4B13C16 (1)
Weight, g/mol:	228.137497
ΔH_f, kcal/mol:	61.68
Dipole, Da:	3.67
IP(EA), eV:	-8.5(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(1H-imidazol-5-yl)phenyl]-N'-propan-2-ylmethanimidamide

Drug info:

PubChemData

Smile

CC(C)N=CNC1=CC=C(C=C1)C2=CN=CN2

DOS

IR

Vibrations