Geometry & MOs

Info

ID:	29422
PubChem CID:	833701
Reduced:	NO4C8H11 (1)
Stoich.:	AB4C8D11 (1)
Weight, g/mol:	327.029835
ΔH_f, kcal/mol:	-140.88
Dipole, Da:	3.02
IP(EA), eV:	-9.95(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,3S)-2-(4-chlorophenyl)-3-nitrospiro[cyclopropane-1,2'-indene]-1',3'-dione

Drug info:

PubChemData

Smile

CCC1=C(OC(=NC1=O)OCC)O

DOS

IR

Vibrations