Geometry & MOs

Info

ID:	282404
PubChem CID:	103925641
Reduced:	N2O4C15H18 (1)
Stoich.:	A2B4C15D18 (1)
Weight, g/mol:	261.136493
ΔH_f, kcal/mol:	-154.98
Dipole, Da:	8.4
IP(EA), eV:	-9.46(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,6-dimethylbenzoyl)-4-methylpyrrolidine-3-carboxylic acid

Drug info:

PubChemData

Smile

C1CC(C1)CC(=O)NC2=CC=C(C=C2)C(=O)NCC(=O)O

DOS

IR

Vibrations