Geometry & MOs

Info

ID:	197484
PubChem CID:	78970061
Reduced:	BrNSO4C13H14 (1)
Stoich.:	ABCD4E13F14 (1)
Weight, g/mol:	255.072928
ΔH_f, kcal/mol:	-95.63
Dipole, Da:	5.51
IP(EA), eV:	-10.09(-1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-fluoro-N-propyl-N-prop-2-ynylbenzenesulfonamide

Drug info:

PubChemData

Smile

CCCN(CC#C)S(=O)(=O)C1=CC(=C(C=C1)Br)C(=O)O

DOS

IR

Vibrations