Geometry & MOs

Info

ID:	82929
PubChem CID:	49856824
Reduced:	OSN7C20H25 (1)
Stoich.:	ABC7D20E25 (1)
Weight, g/mol:	461.177313
ΔH_f, kcal/mol:	36.52
Dipole, Da:	8.21
IP(EA), eV:	-8.31(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-methoxy-3,5-dimethylphenyl)-5-methyl-2-[3-(3-methylsulfonylphenyl)phenyl]imidazol-4-amine

Drug info:

PubChemData

Smile

C1C[C@@H](CNC1)NC(=O)C2=C3C(=NC=C2)N=C(N3)C4=CC=C(S4)N5CC[C@H](C5)N

DOS

IR

Vibrations