Geometry & MOs

Info

ID:	65856
PubChem CID:	46386946
Reduced:	N2O2H13C14 (2)
Stoich.:	A2B2C13D14 (2)
Weight, g/mol:	415.13322
ΔH_f, kcal/mol:	-23.65
Dipole, Da:	5.84
IP(EA), eV:	-8.11(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-fluorophenyl)-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)N5CCOCC5

DOS

IR

Vibrations