Geometry & MOs

Info

ID:	351157
PubChem CID:	127279715
Reduced:	SN3O3C20H29 (1)
Stoich.:	AB3C3D20E29 (1)
Weight, g/mol:	278.083747
ΔH_f, kcal/mol:	-111.12
Dipole, Da:	3.12
IP(EA), eV:	-8.62(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(oxolan-3-ylmethyl)pyrazol-3-yl]-1,3-thiazole-4-carboxamide

Drug info:

PubChemData

Smile

CCN1C2=C(C=CC(=C2)NC(=O)C(C(C)C)S(=O)(=O)C3CCCCC3)C=N1

DOS

IR

Vibrations