Geometry & MOs

Info

ID:	128524
PubChem CID:	51048534
Reduced:	Cl2N2O4C17H18 (1)
Stoich.:	A2B2C4D17E18 (1)
Weight, g/mol:	306.116841
ΔH_f, kcal/mol:	-135.02
Dipole, Da:	9.5
IP(EA), eV:	-8.94(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(2-fluorophenyl)-2-[(E)-3-phenylprop-2-enyl]pyridazin-3-one

Drug info:

PubChemData

Smile

CC1=C(C(=O)C=CN1CCOC)OCC(=O)NC2=CC(=CC(=C2)Cl)Cl

DOS

IR

Vibrations