Geometry & MOs

Info

ID:	65801
PubChem CID:	46386885
Reduced:	NOC7H7 (3)
Stoich.:	ABC7D7 (3)
Weight, g/mol:	407.184506
ΔH_f, kcal/mol:	-21.85
Dipole, Da:	3.4
IP(EA), eV:	-9.02(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)NC(=O)C1=CC=C(C=C1)C2=NN=C(C=C2)OC3=CC=CC=C3OC

DOS

IR

Vibrations