Geometry & MOs

Info

ID:	357728
PubChem CID:	127294402
Reduced:	S2N3O3C12H23 (1)
Stoich.:	A2B3C3D12E23 (1)
Weight, g/mol:	347.108582
ΔH_f, kcal/mol:	-150.56
Dipole, Da:	3.32
IP(EA), eV:	-8.73(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,5-dimethylpyrazol-3-yl)-3-(2-thiomorpholin-4-ylsulfonylethyl)urea

Drug info:

PubChemData

Smile

C1CCC(C1)NC(=O)NCCS(=O)(=O)N2CCSCC2

DOS

IR

Vibrations