Geometry & MOs

Info

ID:	174788
PubChem CID:	75814241
Reduced:	O3C10H10 (2)
Stoich.:	A3B10C10 (2)
Weight, g/mol:	394.10842
ΔH_f, kcal/mol:	-183.59
Dipole, Da:	7.12
IP(EA), eV:	-8.88(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-chloro-4-(1,3-dioxoisoindol-2-yl)phenyl]bicyclo[2.2.1]heptane-2-carboxamide

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)C(=O)C=CC2=CC=C(C=C2)OCCC(=O)O)OC

DOS

IR

Vibrations