Geometry & MOs

Info

ID:	372203
PubChem CID:	131294347
Reduced:	SN2O4C8H10 (1)
Stoich.:	AB2C4D8E10 (1)
Weight, g/mol:	229.052112
ΔH_f, kcal/mol:	-103.33
Dipole, Da:	4.93
IP(EA), eV:	-9.34(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 5-oxo-3-[(4S)-1,3-thiazolidin-4-yl]-1,4-dihydropyrazole-4-carboxylate

Drug info:

PubChemData

Smile

COC(=O)C1=C(ONC1=O)[C@H]2CSCN2

DOS

IR

Vibrations