Geometry & MOs

Info

ID:	357727
PubChem CID:	127294401
Reduced:	S2O3N5C13H23 (1)
Stoich.:	A2B3C5D13E23 (1)
Weight, g/mol:	321.118084
ΔH_f, kcal/mol:	-96.79
Dipole, Da:	5.46
IP(EA), eV:	-8.69(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclopentyl-3-(2-thiomorpholin-4-ylsulfonylethyl)urea

Drug info:

PubChemData

Smile

CCCN1C(=CC=N1)NC(=O)NCCS(=O)(=O)N2CCSCC2

DOS

IR

Vibrations