Geometry & MOs

Info

ID:	129568
PubChem CID:	51073134
Reduced:	SN3O3C13H15 (1)
Stoich.:	AB3C3D13E15 (1)
Weight, g/mol:	337.142641
ΔH_f, kcal/mol:	-32.92
Dipole, Da:	6.44
IP(EA), eV:	-9.38(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-N-quinolin-2-ylacetamide

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(OC=C1)CSC2=NN=CN2CC=C

DOS

IR

Vibrations