Geometry & MOs

Info

ID:	154769
PubChem CID:	56314291
Reduced:	FSN3O3C20H30 (1)
Stoich.:	ABC3D3E20F30 (1)
Weight, g/mol:	392.190006
ΔH_f, kcal/mol:	-160.17
Dipole, Da:	6.71
IP(EA), eV:	-9.07(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2-fluorophenyl)-2-methylpropyl]-1-[(3-methylphenyl)methyl]-2-oxopyridine-3-carboxamide

Drug info:

PubChemData

Smile

CCS(=O)(=O)N1CCC(CC1)C(=O)N2CCCN(CC2)CC3=CC=CC=C3F

DOS

IR

Vibrations