Geometry & MOs

Info

ID:	159934
PubChem CID:	57298708
Reduced:	NO2H8C9 (2)
Stoich.:	AB2C8D9 (2)
Weight, g/mol:	333.067094
ΔH_f, kcal/mol:	-114.63
Dipole, Da:	6.99
IP(EA), eV:	-8.72(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-nitrosopropyl 4-benzoylbenzenesulfonate

Drug info:

PubChemData

Smile

CN1C2=CC=CC=C2C(=C(C1=O)C(=O)NCC3=CC=C(C=C3)O)O

DOS

IR

Vibrations