Geometry & MOs

Info

ID:	260501
PubChem CID:	103193982
Reduced:	NO4C16H19 (1)
Stoich.:	AB4C16D19 (1)
Weight, g/mol:	273.172879
ΔH_f, kcal/mol:	-85.56
Dipole, Da:	8.01
IP(EA), eV:	-10.49(-1.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-aminophenyl)spiro[3.6]decane-2-carboxylic acid

Drug info:

PubChemData

Smile

C1CCC2(CC1)CC(C2)(C3=CC(=CC=C3)[N+](=O)[O-])C(=O)O

DOS

IR

Vibrations