Geometry & MOs

Info

ID:	78739
PubChem CID:	49704001
Reduced:	N2O2H9C10 (2)
Stoich.:	A2B2C9D10 (2)
Weight, g/mol:	351.138305
ΔH_f, kcal/mol:	-6.53
Dipole, Da:	1.99
IP(EA), eV:	-9.51(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-fluorophenyl)-2-methyl-2-(6-oxo-3-phenylpyridazin-1-yl)propanamide

Drug info:

PubChemData

Smile

CC(C)(C(=O)NC1=CC=CC=C1[N+](=O)[O-])N2C(=O)C=CC(=N2)C3=CC=CC=C3

DOS

IR

Vibrations