Geometry & MOs

Info

ID:	281194
PubChem CID:	103911375
Reduced:	N3C16H21 (1)
Stoich.:	A3B16C21 (1)
Weight, g/mol:	280.124549
ΔH_f, kcal/mol:	69.47
Dipole, Da:	3.05
IP(EA), eV:	-8.76(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[1-(hex-5-ynylamino)ethyl]benzenesulfonamide

Drug info:

PubChemData

Smile

CC(C1=NC2=CC=CC=C2N1C)NCCCCC#C

DOS

IR

Vibrations