Geometry & MOs

Info

ID:	56554
PubChem CID:	17436276
Reduced:	ClSO2N3C13H16 (1)
Stoich.:	ABC2D3E13F16 (1)
Weight, g/mol:	337.146013
ΔH_f, kcal/mol:	-6.21
Dipole, Da:	4.08
IP(EA), eV:	-9.03(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,5,6-trimethyl-2-[2-oxo-2-(oxolan-2-ylmethylamino)ethyl]sulfanylpyridine-3-carboxamide

Drug info:

PubChemData

Smile

CCN(CC1=CC=C(S1)Cl)CC(=O)NC2=NOC(=C2)C

DOS

IR

Vibrations