Geometry & MOs

Info

ID:	314566
PubChem CID:	126622188
Reduced:	NO7H9C11 (1)
Stoich.:	AB7C9D11 (1)
Weight, g/mol:	259.90533
ΔH_f, kcal/mol:	-184.87
Dipole, Da:	5.65
IP(EA), eV:	-10.23(-1.93)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

2-phenylacetonitrile;zinc;hydrobromide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations