Geometry & MOs

Info

ID:	130916
PubChem CID:	51128416
Reduced:	FON2C19H23 (1)
Stoich.:	ABC2D19E23 (1)
Weight, g/mol:	358.092912
ΔH_f, kcal/mol:	-61.29
Dipole, Da:	6.92
IP(EA), eV:	-8.25(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-phenacyl-6-phenyl-4-(trifluoromethyl)pyridazin-3-one

Drug info:

PubChemData

Smile

CCCN(C)C1=CC=C(C=C1)C(=O)NC(C)C2=CC(=CC=C2)F

DOS

IR

Vibrations