Geometry & MOs

Info

ID:	51877
PubChem CID:	12014637
Reduced:	ClN2O2H13C17 (1)
Stoich.:	AB2C2D13E17 (1)
Weight, g/mol:	292.121178
ΔH_f, kcal/mol:	6.4
Dipole, Da:	5.98
IP(EA), eV:	-9.15(-1.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[(4-methoxyphenyl)methylidene]-4-(4-methylphenyl)imidazol-2-one

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)/C=C\2/C(=NC(=O)N2)C3=CC=C(C=C3)Cl

DOS

IR

Vibrations