Geometry & MOs

Info

ID:	202593
PubChem CID:	79696510
Reduced:	NS2O4C13H15 (1)
Stoich.:	AB2C4D13E15 (1)
Weight, g/mol:	291.1293
ΔH_f, kcal/mol:	-101.79
Dipole, Da:	6.96
IP(EA), eV:	-9.81(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,4-dimethylcyclohexyl)-5-(3-hydroxyprop-1-ynyl)thiophene-3-carboxamide

Drug info:

PubChemData

Smile

C1CC(CS(=O)(=O)C1)NC(=O)C2=CSC(=C2)C#CCO

DOS

IR

Vibrations