Geometry & MOs

Info

ID:	173555
PubChem CID:	75652600
Reduced:	N4O5H24C25 (1)
Stoich.:	A4B5C24D25 (1)
Weight, g/mol:	448.095175
ΔH_f, kcal/mol:	-88.02
Dipole, Da:	4.74
IP(EA), eV:	-8.81(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

(4-chlorophenyl)-[2-(3,4-dimethoxyphenyl)-4,5-dioxo-1-phenylpyrrolidin-3-ylidene]methanolate

Drug info:

PubChemData

Smile

CCOC1=C(C=CC(=C1)C(=C2C(=NNC2=O)C)C3=C(NNC3=O)C)OC(=O)C4=CC=CC(=C4)C

DOS

IR

Vibrations