Geometry & MOs

Info

ID:	279730
PubChem CID:	103844858
Reduced:	NSF2O3C13H19 (1)
Stoich.:	ABC2D3E13F19 (1)
Weight, g/mol:	299.155515
ΔH_f, kcal/mol:	-211.67
Dipole, Da:	4.62
IP(EA), eV:	-10.12(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-ethyl-N-[2-ethyl-2-(hydroxymethyl)butyl]benzenesulfonamide

Drug info:

PubChemData

Smile

CCC(CC)(CNS(=O)(=O)C1=CC(=C(C=C1)F)F)CO

DOS

IR

Vibrations