Geometry & MOs

Info

ID:	151464
PubChem CID:	53812414
Reduced:	SN2O3C24H30 (1)
Stoich.:	AB2C3D24E30 (1)
Weight, g/mol:	528.088659
ΔH_f, kcal/mol:	-97.59
Dipole, Da:	8.2
IP(EA), eV:	-8.54(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2,2-trichloro-N'-(5-hydroxy-3-methyl-2-oxo-1-phenylimidazol-4-yl)-N,N-bis(2-methylphenyl)ethanimidamide

Drug info:

PubChemData

Smile

COC[C@@H]1CCCN1C(=O)C2CC(C(=O)N3C2C4C(CC3)C=CS4)C5=CC=CC=C5

DOS

IR

Vibrations