Geometry & MOs

Info

ID:	357729
PubChem CID:	127294403
Reduced:	S2O3N5C12H21 (1)
Stoich.:	A2B3C5D12E21 (1)
Weight, g/mol:	337.033703
ΔH_f, kcal/mol:	-94.82
Dipole, Da:	6.35
IP(EA), eV:	-8.87(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=NN(C(=C1)NC(=O)NCCS(=O)(=O)N2CCSCC2)C

DOS

IR

Vibrations