Geometry & MOs

Info

ID:	335983
PubChem CID:	127254990
Reduced:	N3O3H21C23 (1)
Stoich.:	A3B3C21D23 (1)
Weight, g/mol:	358.152872
ΔH_f, kcal/mol:	-26.48
Dipole, Da:	2.51
IP(EA), eV:	-8.46(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(2,4-dimethoxyphenyl)pyrrolidine-1-carbonyl]-5-methoxy-1H-pyridin-4-one

Drug info:

PubChemData

Smile

COC1=CNC(=CC1=O)C(=O)NCC(C2=CC=CC=C2)C3=CNC4=CC=CC=C43

DOS

IR

Vibrations