Geometry & MOs

Info

ID:	365775
PubChem CID:	127318500
Reduced:	O3N4C21H22 (1)
Stoich.:	A3B4C21D22 (1)
Weight, g/mol:	368.209993
ΔH_f, kcal/mol:	-76.31
Dipole, Da:	3.66
IP(EA), eV:	-9.57(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN1C2=C(C=CC(=N2)C(=O)NC3(CCCC3)C4=CC=CC=C4)C(=O)N(C1=O)C

DOS

IR

Vibrations