Geometry & MOs

Info

ID:	87047
PubChem CID:	49891085
Reduced:	BrNSO4H10C17 (1)
Stoich.:	ABCD4E10F17 (1)
Weight, g/mol:	423.073636
ΔH_f, kcal/mol:	-87.86
Dipole, Da:	4.35
IP(EA), eV:	-9.48(-1.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[(4-hydroxy-3-methoxy-5-nitrophenyl)methylidene]-3-(2-morpholin-4-yl-2-oxoethyl)-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)Br)/C=C\3/C(=O)NC(=O)S3

DOS

IR

Vibrations