Geometry & MOs

Info

ID:	174099
PubChem CID:	75723930
Reduced:	ClN3O3C25H26 (1)
Stoich.:	AB3C3D25E26 (1)
Weight, g/mol:	308.116092
ΔH_f, kcal/mol:	-65.78
Dipole, Da:	3.57
IP(EA), eV:	-8.89(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-3-(4-methoxybenzoyl)-2-phenyl-1,2-dihydropyrrol-5-one

Drug info:

PubChemData

Smile

CC(C)(C)NC(=O)C(C1=CC(=CC=C1)OC)N(C2=CC=CC=C2Cl)C(=O)C3=CN=CC=C3

DOS

IR

Vibrations