Geometry & MOs

Info

ID:	196272
PubChem CID:	78804379
Reduced:	O4C17H24 (1)
Stoich.:	A4B17C24 (1)
Weight, g/mol:	312.054419
ΔH_f, kcal/mol:	-177.31
Dipole, Da:	5.46
IP(EA), eV:	-8.88(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(difluoromethylsulfanyl)-N-(2-fluoro-5-methylphenyl)pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CCOC1=CC=CC=C1CCC(=O)OCC2CCCCO2

DOS

IR

Vibrations