Geometry & MOs

Info

ID:	65885
PubChem CID:	46386979
Reduced:	FN3O3H18C24 (1)
Stoich.:	AB3C3D18E24 (1)
Weight, g/mol:	445.143784
ΔH_f, kcal/mol:	-28.95
Dipole, Da:	5.16
IP(EA), eV:	-8.38(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,4-dimethoxyphenyl)-4-[6-(4-fluorophenoxy)pyridazin-3-yl]benzamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)C3=NN=C(C=C3)OC4=CC=C(C=C4)F

DOS

IR

Vibrations