Geometry & MOs

Info

ID:	449056
PubChem CID:	135295618
Reduced:	SN2O3C25H32 (1)
Stoich.:	AB2C3D25E32 (1)
Weight, g/mol:	189.08235
ΔH_f, kcal/mol:	-73.77
Dipole, Da:	4.34
IP(EA), eV:	-8.39(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-3-(1-oxo-1,2-thiazolidin-2-yl)butan-2-one

Drug info:

PubChemData

Smile

C/C=C\C(=C/C)\C(C)CN(CC(CN1C2=CC=CC=C2C3=CC=CC=C31)O)S(=O)(=O)C

DOS

IR

Vibrations