Geometry & MOs

Info

ID:	343071
PubChem CID:	127266244
Reduced:	NSO3C14H19 (1)
Stoich.:	ABC3D14E19 (1)
Weight, g/mol:	269.072179
ΔH_f, kcal/mol:	-65.24
Dipole, Da:	4.97
IP(EA), eV:	-9.97(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-hydroxybut-3-yn-2-yl)-4-methoxy-2-methylbenzenesulfonamide

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC(CO)C#C

DOS

IR

Vibrations