Geometry & MOs

Info

ID:	198070
PubChem CID:	79042615
Reduced:	N2O2C13H18 (1)
Stoich.:	A2B2C13D18 (1)
Weight, g/mol:	282.064057
ΔH_f, kcal/mol:	-77.03
Dipole, Da:	6.19
IP(EA), eV:	-8.9(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-methylpyridin-3-yl)-1,3-dioxoisoindole-5-carboxylic acid

Drug info:

PubChemData

Smile

CC1C(CCCN1)NC(=O)C2=CC=CC=C2O

DOS

IR

Vibrations