Geometry & MOs

Info

ID:	367691
PubChem CID:	127325442
Reduced:	SN2O3C14H20 (1)
Stoich.:	AB2C3D14E20 (1)
Weight, g/mol:	354.082033
ΔH_f, kcal/mol:	-124.8
Dipole, Da:	5.91
IP(EA), eV:	-9.86(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,1-dioxothian-3-yl)-4-methyl-2-(1-methylpyrazol-4-yl)-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

CC(CC(=O)NC1CCCS(=O)(=O)C1)C2=CN=CC=C2

DOS

IR

Vibrations