Geometry & MOs

Info

ID:	65873
PubChem CID:	46386963
Reduced:	FN3O3C22H22 (1)
Stoich.:	AB3C3D22E22 (1)
Weight, g/mol:	351.138305
ΔH_f, kcal/mol:	-71.55
Dipole, Da:	2.39
IP(EA), eV:	-9.45(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[6-(4-fluorophenoxy)pyridazin-3-yl]-N-propylbenzamide

Drug info:

PubChemData

Smile

CCOCCCNC(=O)C1=CC=C(C=C1)C2=NN=C(C=C2)OC3=CC=C(C=C3)F

DOS

IR

Vibrations