Geometry & MOs

Info

ID:	363613
PubChem CID:	127311692
Reduced:	SO3N4C13H26 (1)
Stoich.:	AB3C4D13E26 (1)
Weight, g/mol:	350.144633
ΔH_f, kcal/mol:	-126.63
Dipole, Da:	4.01
IP(EA), eV:	-8.84(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-methylsulfonylpiperidin-3-yl)-3-(2-thiomorpholin-4-ylethyl)urea

Drug info:

PubChemData

Smile

CN(CCNC(=O)NC1CCCN(C1)S(=O)(=O)C)C2CC2

DOS

IR

Vibrations