Geometry & MOs

Info

ID:	20510
PubChem CID:	584365
Reduced:	SN2O4H16C19 (1)
Stoich.:	AB2C4D16E19 (1)
Weight, g/mol:	368.083078
ΔH_f, kcal/mol:	-100.3
Dipole, Da:	6.13
IP(EA), eV:	-9.0(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-[(5-benzylidene-2,4-dioxo-1,3-thiazolidin-3-yl)methylamino]benzoate

Drug info:

PubChemData

Smile

COC(=O)C1=CC=C(C=C1)NCN2C(=O)C(=CC3=CC=CC=C3)SC2=O

DOS

IR

Vibrations