Geometry & MOs

Info

ID:	272784
PubChem CID:	103756910
Reduced:	BrClNSO2C12H13 (1)
Stoich.:	ABCDE2F12G13 (1)
Weight, g/mol:	266.108899
ΔH_f, kcal/mol:	-24.33
Dipole, Da:	3.56
IP(EA), eV:	-10.07(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-hex-5-ynyl-2-pyridin-2-ylethanesulfonamide

Drug info:

PubChemData

Smile

C#CCCCCNS(=O)(=O)C1=C(C=C(C=C1)Br)Cl

DOS

IR

Vibrations