Geometry & MOs

Info

ID:	154
PubChem CID:	2196
Reduced:	NO3C12H13 (1)
Stoich.:	AB3C12D13 (1)
Weight, g/mol:	219.089543
ΔH_f, kcal/mol:	-103.89
Dipole, Da:	1.18
IP(EA), eV:	-9.14(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-methoxybenzoyl)pyrrolidin-2-one

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C(=O)N2CCCC2=O

DOS

IR

Vibrations