Geometry & MOs

Info

ID:	394995
PubChem CID:	135024366
Reduced:	SF2N2O2H20C28 (1)
Stoich.:	AB2C2D2E20F28 (1)
Weight, g/mol:	506.202799
ΔH_f, kcal/mol:	-31.77
Dipole, Da:	2.52
IP(EA), eV:	-8.68(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[(5-phenylfuran-2-yl)methylidene]-3-(3-phenylpropyl)-2-(3-phenylpropylimino)-1,3-thiazolidin-4-one

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC=C(O2)/C=C\3/C(=O)N(C(=NCC4=CC(=CC=C4)F)S3)CC5=CC(=CC=C5)F

DOS

IR

Vibrations