Geometry & MOs

Info

ID:	309866
PubChem CID:	126563307
Reduced:	NO3C12H15 (1)
Stoich.:	AB3C12D15 (1)
Weight, g/mol:	237.100108
ΔH_f, kcal/mol:	-134.82
Dipole, Da:	4.21
IP(EA), eV:	-9.8(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

prop-2-enyl 1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindole-2-carboxylate

Drug info:

PubChemData

Smile

CCC(=O)N1C(=O)C2CC=C(CC2C1=O)C

DOS

IR

Vibrations