Geometry & MOs

Info

ID:	272778
PubChem CID:	103756868
Reduced:	ClSN2C11H15 (1)
Stoich.:	ABC2D11E15 (1)
Weight, g/mol:	245.14495
ΔH_f, kcal/mol:	9.35
Dipole, Da:	5.06
IP(EA), eV:	-8.79(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-hex-5-ynyl-3,3-dimethylbutane-1-sulfonamide

Drug info:

PubChemData

Smile

C1CSCCC1CNC2=CC(=NC=C2)Cl

DOS

IR

Vibrations