Geometry & MOs

Info

ID:	343670
PubChem CID:	127266846
Reduced:	NSO3C14H19 (1)
Stoich.:	ABC3D14E19 (1)
Weight, g/mol:	269.072179
ΔH_f, kcal/mol:	-67.02
Dipole, Da:	5.23
IP(EA), eV:	-9.9(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-hydroxybut-2-ynyl)-4-methoxy-2-methylbenzenesulfonamide

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NCC#CCO

DOS

IR

Vibrations