Geometry & MOs

Info

ID:	397037
PubChem CID:	135029633
Reduced:	N2O4H14C17 (1)
Stoich.:	A2B4C14D17 (1)
Weight, g/mol:	265.086956
ΔH_f, kcal/mol:	-24.29
Dipole, Da:	5.77
IP(EA), eV:	-10.08(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6'-chloro-2'-methoxyspiro[cyclohexane-1,3'-isoindole]-1'-one

Drug info:

PubChemData

Smile

CC(=O)N/C(=C\C(=O)C1=CC=CC=C1)/C2=CC(=CC=C2)[N+](=O)[O-]

DOS

IR

Vibrations