Geometry & MOs

Info

ID:	353183
PubChem CID:	127284363
Reduced:	SN2O4C19H20 (1)
Stoich.:	AB2C4D19E20 (1)
Weight, g/mol:	368.119464
ΔH_f, kcal/mol:	-115.1
Dipole, Da:	5.56
IP(EA), eV:	-9.09(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-propanoyl-N-(9H-xanthen-9-yl)-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

C1CS(=O)(=O)CCN1CC(=O)NC2C3=CC=CC=C3OC4=CC=CC=C24

DOS

IR

Vibrations