Geometry & MOs

Info

ID:	278588
PubChem CID:	103836609
Reduced:	SN2O5C13H20 (1)
Stoich.:	AB2C5D13E20 (1)
Weight, g/mol:	258.103814
ΔH_f, kcal/mol:	-134.34
Dipole, Da:	2.82
IP(EA), eV:	-10.3(-1.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-hydroxy-2,2-dimethylbutyl)pyridine-3-sulfonamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1S(=O)(=O)NCC(C)(C)CCO)[N+](=O)[O-]

DOS

IR

Vibrations