Geometry & MOs

Info

ID:	65820
PubChem CID:	46386904
Reduced:	N3O4H21C25 (1)
Stoich.:	A3B4C21D25 (1)
Weight, g/mol:	415.13322
ΔH_f, kcal/mol:	-19.85
Dipole, Da:	8.24
IP(EA), eV:	-8.66(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)NC(=O)C2=CC=C(C=C2)C3=NN=C(C=C3)OC4=CC=CC=C4OC

DOS

IR

Vibrations