Geometry & MOs

Info

ID:	122748
PubChem CID:	50820393
Reduced:	FOSN3C19H24 (1)
Stoich.:	ABCD3E19F24 (1)
Weight, g/mol:	383.203134
ΔH_f, kcal/mol:	-47.04
Dipole, Da:	3.54
IP(EA), eV:	-8.79(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(2-piperidin-1-ylethylsulfanyl)-N-(4-propan-2-ylphenyl)pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CCN(CC)CCSC1=NC=C(C=C1)C(=O)NCC2=CC=C(C=C2)F

DOS

IR

Vibrations