Geometry & MOs

Info

ID:	65836
PubChem CID:	46386924
Reduced:	N3O3H21C25 (1)
Stoich.:	A3B3C21D25 (1)
Weight, g/mol:	425.173942
ΔH_f, kcal/mol:	19.38
Dipole, Da:	3.87
IP(EA), eV:	-8.94(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[6-(2-methoxyphenoxy)pyridazin-3-yl]-N-[(3-methylphenyl)methyl]benzamide

Drug info:

PubChemData

Smile

COC1=CC=CC=C1OC2=NN=C(C=C2)C3=CC=C(C=C3)C(=O)NCC4=CC=CC=C4

DOS

IR

Vibrations