Geometry & MOs

Info

ID:	358256
PubChem CID:	127295801
Reduced:	SO3N4C15H28 (1)
Stoich.:	AB3C4D15E28 (1)
Weight, g/mol:	319.156577
ΔH_f, kcal/mol:	-139.52
Dipole, Da:	5.11
IP(EA), eV:	-8.74(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(1,1-dioxo-1,2-thiazolidin-2-yl)ethyl]-1-methyl-1-(oxan-3-ylmethyl)urea

Drug info:

PubChemData

Smile

C1CCN(CC1)C2CCN(C2)C(=O)NCCN3CCCS3(=O)=O

DOS

IR

Vibrations