Geometry & MOs

Info

ID:	298572
PubChem CID:	117651236
Reduced:	NCl2O2C9H9 (1)
Stoich.:	AB2C2D9E9 (1)
Weight, g/mol:	260.104859
ΔH_f, kcal/mol:	-13.98
Dipole, Da:	6.87
IP(EA), eV:	-10.18(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-benzyl-6,10-dioxaspiro[4.5]decane-7,9-dione

Drug info:

PubChemData

Smile

CCCC1=CC(=C(C(=C1)Cl)[N+](=O)[O-])Cl

DOS

IR

Vibrations