Geometry & MOs

Info

ID:	246719
PubChem CID:	103064731
Reduced:	OSN3C16H25 (1)
Stoich.:	ABC3D16E25 (1)
Weight, g/mol:	307.171834
ΔH_f, kcal/mol:	-48.2
Dipole, Da:	4.95
IP(EA), eV:	-8.62(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-propyl-6-(propylamino)-N-(thiolan-3-yl)pyridine-4-carboxamide

Drug info:

PubChemData

Smile

CCNC1=CC(=CC(=N1)C(C)(C)C)C(=O)NC2CCSC2

DOS

IR

Vibrations