Geometry & MOs

Info

ID:	171182
PubChem CID:	75339899
Reduced:	NSO5C15H15 (1)
Stoich.:	ABC5D15E15 (1)
Weight, g/mol:	636.05395
ΔH_f, kcal/mol:	-182.75
Dipole, Da:	2.87
IP(EA), eV:	-9.18(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(2,4-dimorpholin-4-yl-5-nitrophenyl)methylidene]-3-[(4-iodophenyl)methyl]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CC(C)OC(=O)CN1C(=O)C(=CC2=CC=CC=C2O)SC1=O

DOS

IR

Vibrations