Geometry & MOs

Info

ID:	260500
PubChem CID:	103193980
Reduced:	NO4C12H15 (1)
Stoich.:	AB4C12D15 (1)
Weight, g/mol:	289.131408
ΔH_f, kcal/mol:	-90.71
Dipole, Da:	3.37
IP(EA), eV:	-10.54(-1.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-nitrophenyl)spiro[3.5]nonane-2-carboxylic acid

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations