Geometry & MOs

Info

ID:	337385
PubChem CID:	127257070
Reduced:	NSO4C10H11 (1)
Stoich.:	ABC4D10E11 (1)
Weight, g/mol:	329.108565
ΔH_f, kcal/mol:	-134.23
Dipole, Da:	1.9
IP(EA), eV:	-9.22(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(4-methoxyphenyl)phenyl]methyl 1,3-thiazolidine-3-carboxylate

Drug info:

PubChemData

Smile

C1CSCN1C(=O)OC2=CCC(=O)CC2=O

DOS

IR

Vibrations