Geometry & MOs

Info

ID:	153926
PubChem CID:	56313268
Reduced:	FSN2O2C21H21 (1)
Stoich.:	ABC2D2E21F21 (1)
Weight, g/mol:	381.185255
ΔH_f, kcal/mol:	-53.56
Dipole, Da:	5.62
IP(EA), eV:	-8.98(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-benzyl-N-[2-(2-fluorophenyl)-2-methylpropyl]-6-oxo-4,5-dihydropyridazine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)(CNC(=O)C1=CSC(=N1)C2=CC=CC=C2OC)C3=CC=CC=C3F

DOS

IR

Vibrations