Geometry & MOs

Info

ID:	65913
PubChem CID:	46387023
Reduced:	N3O4H21C24 (1)
Stoich.:	A3B4C21D24 (1)
Weight, g/mol:	457.163771
ΔH_f, kcal/mol:	-26.29
Dipole, Da:	2.96
IP(EA), eV:	-8.83(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,4-dimethoxyphenyl)-3-[6-(4-methoxyphenoxy)pyridazin-3-yl]benzamide

Drug info:

PubChemData

Smile

CC1=CC=C(O1)CNC(=O)C2=CC=CC(=C2)C3=NN=C(C=C3)OC4=CC=C(C=C4)OC

DOS

IR

Vibrations