Geometry & MOs

Info

ID:	337391
PubChem CID:	127257076
Reduced:	N2S2O3C15H18 (1)
Stoich.:	A2B2C3D15E18 (1)
Weight, g/mol:	308.119464
ΔH_f, kcal/mol:	-96.36
Dipole, Da:	4.14
IP(EA), eV:	-8.93(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(4-carbamoylphenyl)-2-methylpropan-2-yl] 1,3-thiazolidine-3-carboxylate

Drug info:

PubChemData

Smile

C1CSCN1C(=O)C2=CC=C(C=C2)COC(=O)N3CCSC3

DOS

IR

Vibrations