Geometry & MOs

Info

ID:	278384
PubChem CID:	103835207
Reduced:	BrClSN2O3C12H18 (1)
Stoich.:	ABCD2E3F12G18 (1)
Weight, g/mol:	314.110042
ΔH_f, kcal/mol:	-109.15
Dipole, Da:	6.33
IP(EA), eV:	-10.3(-1.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyano-N-(3-ethyl-2-hydroxypentyl)-3-fluorobenzenesulfonamide

Drug info:

PubChemData

Smile

CCC(CC)C(CNS(=O)(=O)C1=C(N=CC(=C1)Br)Cl)O

DOS

IR

Vibrations