Geometry & MOs

Info

ID:	279711
PubChem CID:	103844791
Reduced:	NSO3C11H23 (1)
Stoich.:	ABC3D11E23 (1)
Weight, g/mol:	275.130363
ΔH_f, kcal/mol:	-141.23
Dipole, Da:	2.58
IP(EA), eV:	-10.0(0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-ethyl-2-(hydroxymethyl)butyl]-1-methylpyrazole-4-sulfonamide

Drug info:

PubChemData

Smile

CCC(CC)(CNS(=O)(=O)CC1CC1)CO

DOS

IR

Vibrations