Geometry & MOs

Info

ID:	351180
PubChem CID:	127279738
Reduced:	N2S2O3C19H20 (1)
Stoich.:	A2B2C3D19E20 (1)
Weight, g/mol:	388.091535
ΔH_f, kcal/mol:	-75.61
Dipole, Da:	6.17
IP(EA), eV:	-8.59(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(1-hydroxynaphthalene-2-carbonyl)-1,3-thiazolidin-4-yl]-thiomorpholin-4-ylmethanone

Drug info:

PubChemData

Smile

C1CSCCN1C(=O)C2CSCN2C(=O)C3=CC4=CC=CC=C4C=C3O

DOS

IR

Vibrations