Geometry & MOs

Info

ID:	128418
PubChem CID:	51043241
Reduced:	SN3O3H15C18 (1)
Stoich.:	AB3C3D15E18 (1)
Weight, g/mol:	423.159434
ΔH_f, kcal/mol:	-24.44
Dipole, Da:	4.73
IP(EA), eV:	-8.88(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(4-fluoro-2-methoxyphenyl)-2-[2-oxo-2-(2-phenylmorpholin-4-yl)ethyl]pyridazin-3-one

Drug info:

PubChemData

Smile

CC(=O)NC1=CC=C(C=C1)C(=O)CN2C(=O)C=CC(=N2)C3=CC=CS3

DOS

IR

Vibrations