Geometry & MOs

Info

ID:	202063
PubChem CID:	79622897
Reduced:	SN2O4C11H24 (1)
Stoich.:	AB2C4D11E24 (1)
Weight, g/mol:	273.125946
ΔH_f, kcal/mol:	-194.03
Dipole, Da:	7.28
IP(EA), eV:	-9.18(0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[(1-methylsulfonylpiperidin-3-yl)methyl]triazol-4-yl]methanamine

Drug info:

PubChemData

Smile

CS(=O)(=O)N1CCCC(C1)CN(CCO)CCO

DOS

IR

Vibrations