Geometry & MOs

Info

ID:	337386
PubChem CID:	127257071
Reduced:	NSO3C18H19 (1)
Stoich.:	ABC3D18E19 (1)
Weight, g/mol:	313.11365
ΔH_f, kcal/mol:	-78.23
Dipole, Da:	1.45
IP(EA), eV:	-8.86(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C2=CC=CC=C2COC(=O)N3CCSC3

DOS

IR

Vibrations