Geometry & MOs

Info

ID:	357813
PubChem CID:	127294656
Reduced:	S2N3O4C13H25 (1)
Stoich.:	A2B3C4D13E25 (1)
Weight, g/mol:	351.128649
ΔH_f, kcal/mol:	-194.96
Dipole, Da:	0.85
IP(EA), eV:	-8.75(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1-hydroxycyclopentyl)methyl]-3-(2-thiomorpholin-4-ylsulfonylethyl)urea

Drug info:

PubChemData

Smile

C1CC(CN(C1)C(=O)NCCS(=O)(=O)N2CCSCC2)CO

DOS

IR

Vibrations