Geometry & MOs

Info

ID:	10563
PubChem CID:	104382
Reduced:	NO2C9H9 (1)
Stoich.:	AB2C9D9 (1)
Weight, g/mol:	163.063329
ΔH_f, kcal/mol:	3.95
Dipole, Da:	2.86
IP(EA), eV:	-9.52(-1.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-nitrosophenyl)propan-1-one

Drug info:

PubChemData

Smile

CCC(=O)C1=CC=C(C=C1)N=O

DOS

IR

Vibrations