Geometry & MOs

Info

ID:	78644
PubChem CID:	49703385
Reduced:	N4O6H20C21 (1)
Stoich.:	A4B6C20D21 (1)
Weight, g/mol:	363.158292
ΔH_f, kcal/mol:	-79.26
Dipole, Da:	13.66
IP(EA), eV:	-9.09(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(4-methoxyphenyl)-6-oxopyridazin-1-yl]-N-methyl-N-phenylpropanamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations