Geometry & MOs

Info

ID:	368164
PubChem CID:	127327715
Reduced:	SN2O2C13H26 (1)
Stoich.:	AB2C2D13E26 (1)
Weight, g/mol:	285.151098
ΔH_f, kcal/mol:	-116.81
Dipole, Da:	3.04
IP(EA), eV:	-9.39(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-tert-butyl-1-(1-methylpyrazol-4-yl)sulfonylpiperidine

Drug info:

PubChemData

Smile

CC(C)(C)C1CCN(CC1)S(=O)(=O)N2CCCC2

DOS

IR

Vibrations