Geometry & MOs

Info

ID:	364136
PubChem CID:	127314309
Reduced:	SO3N5C13H19 (1)
Stoich.:	AB3C5D13E19 (1)
Weight, g/mol:	291.125277
ΔH_f, kcal/mol:	-87.06
Dipole, Da:	8.16
IP(EA), eV:	-9.63(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CN(S(=O)(=O)C1)CCNC(=O)N2CCC3=CN=CN=C3C2

DOS

IR

Vibrations