Geometry & MOs

Info

ID:	271900
PubChem CID:	103698085
Reduced:	NSO2F3C12H12 (1)
Stoich.:	ABC2D3E12F12 (1)
Weight, g/mol:	258.022977
ΔH_f, kcal/mol:	-175.19
Dipole, Da:	5.04
IP(EA), eV:	-10.12(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-N-pent-4-ynylpyridine-3-sulfonamide

Drug info:

PubChemData

Smile

C#CCCCNS(=O)(=O)C1=CC=CC=C1C(F)(F)F

DOS

IR

Vibrations