Geometry & MOs

Info

ID:	77589
PubChem CID:	49655581
Reduced:	F3N3O3C12H14 (1)
Stoich.:	A3B3C3D12E14 (1)
Weight, g/mol:	344.072784
ΔH_f, kcal/mol:	-254.44
Dipole, Da:	8.09
IP(EA), eV:	-9.73(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-chlorophenyl)methyl]-6-(4-fluoro-2-methoxyphenyl)pyridazin-3-one

Drug info:

PubChemData

Smile

COCCCNC(=O)C(=O)NC1=CN=C(C=C1)C(F)(F)F

DOS

IR

Vibrations