Geometry & MOs

Info

ID:	26355
PubChem CID:	645320
Reduced:	ClO2N4C25H29 (1)
Stoich.:	AB2C4D25E29 (1)
Weight, g/mol:	368.137222
ΔH_f, kcal/mol:	-62.28
Dipole, Da:	6.17
IP(EA), eV:	-8.96(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-acetyl-2-(2,5-dimethoxyphenyl)-4-hydroxy-1-(pyridin-3-ylmethyl)-2H-pyrrol-5-one

Drug info:

PubChemData

Smile

CC1=C2C=C(C(=O)NC2=C(C=C1)C)CN(CCN3CCCC3)C(=O)NC4=CC(=CC=C4)Cl

DOS

IR

Vibrations