Geometry & MOs

Info

ID:	14003
PubChem CID:	401420
Reduced:	NSO4H17C18 (1)
Stoich.:	ABC4D17E18 (1)
Weight, g/mol:	343.087829
ΔH_f, kcal/mol:	-80.86
Dipole, Da:	3.6
IP(EA), eV:	-9.22(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclopropyl-1,1-dioxo-2-(3-phenoxyphenyl)-1,3-thiazolidin-4-one

Drug info:

PubChemData

Smile

C1CC1N2C(S(=O)(=O)CC2=O)C3=CC(=CC=C3)OC4=CC=CC=C4

DOS

IR

Vibrations