Geometry & MOs

Info

ID:	69989
PubChem CID:	47206417
Reduced:	N2O2S2C13H22 (1)
Stoich.:	A2B2C2D13E22 (1)
Weight, g/mol:	302.177647
ΔH_f, kcal/mol:	-64.2
Dipole, Da:	5.35
IP(EA), eV:	-8.78(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[[2-cyanoethyl(methyl)sulfamoyl]amino]ethyl]-3,5-dimethylpiperidine

Drug info:

PubChemData

Smile

CC1CC(CN(C1)CCNS(=O)(=O)C2=CC=CS2)C

DOS

IR

Vibrations