Geometry & MOs

Info

ID:	410870
PubChem CID:	135083671
Reduced:	NO2C11H21 (1)
Stoich.:	AB2C11D21 (1)
Weight, g/mol:	253.077265
ΔH_f, kcal/mol:	-126.07
Dipole, Da:	2.14
IP(EA), eV:	-8.94(0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-hydroxybut-2-ynyl)-N,4-dimethylbenzenesulfonamide

Drug info:

PubChemData

Smile

CCCCC=CNC(=O)OC(C)(C)C

DOS

IR

Vibrations