Geometry & MOs

Info

ID:	70139
PubChem CID:	47208085
Reduced:	N2S2O3C13H22 (1)
Stoich.:	A2B2C3D13E22 (1)
Weight, g/mol:	304.091535
ΔH_f, kcal/mol:	-131.7
Dipole, Da:	1.74
IP(EA), eV:	-9.19(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-propan-2-yl-1,3-thiazol-4-yl)methylsulfonyl]-N-propylacetamide

Drug info:

PubChemData

Smile

CCNC(=O)CCS(=O)(=O)CC1=CSC(=N1)C(C)(C)C

DOS

IR

Vibrations