Geometry & MOs

Info

ID:	344412
PubChem CID:	127267588
Reduced:	N2O3C19H32 (1)
Stoich.:	A2B3C19D32 (1)
Weight, g/mol:	368.053231
ΔH_f, kcal/mol:	-178.46
Dipole, Da:	3.61
IP(EA), eV:	-9.35(0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-6-(1-methylimidazol-2-yl)sulfanyl-N-(thian-4-yl)pyridine-3-carboxamide

Drug info:

PubChemData

Smile

C1CCC(C1)CC(=O)NCC(=O)N2CCC(CC2)OC3CCCC3

DOS

IR

Vibrations