Geometry & MOs

Info

ID:	82471
PubChem CID:	49856073
Reduced:	N5H23C25 (1)
Stoich.:	A5B23C25 (1)
Weight, g/mol:	357.124405
ΔH_f, kcal/mol:	161.76
Dipole, Da:	2.54
IP(EA), eV:	-9.07(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4-amino-2-(4-methoxy-3,5-dimethylphenyl)-5-methylimidazol-2-yl]-2-chlorophenol

Drug info:

PubChemData

Smile

CC#CC1=CC(=CN=C1)C2=CC(=CC=C2)C3(N=C(C(=N3)N)C)C4=CC(=NC(=C4)C)C

DOS

IR

Vibrations