Geometry & MOs

Info

ID:	65859
PubChem CID:	46386949
Reduced:	N3O5H23C26 (1)
Stoich.:	A3B5C23D26 (1)
Weight, g/mol:	457.163771
ΔH_f, kcal/mol:	-60.12
Dipole, Da:	5.24
IP(EA), eV:	-8.18(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,5-dimethoxyphenyl)-4-[6-(3-methoxyphenoxy)pyridazin-3-yl]benzamide

Drug info:

PubChemData

Smile

COC1=CC(=CC=C1)OC2=NN=C(C=C2)C3=CC=C(C=C3)C(=O)NC4=CC(=C(C=C4)OC)OC

DOS

IR

Vibrations