Geometry & MOs

Info

ID:	86995
PubChem CID:	49890388
Reduced:	FNSO2H16C23 (1)
Stoich.:	ABCD2E16F23 (1)
Weight, g/mol:	483.011027
ΔH_f, kcal/mol:	-40.84
Dipole, Da:	3.76
IP(EA), eV:	-9.46(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[2,6-dichloro-4-[(Z)-[3-[(4-fluorophenyl)methyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl]phenoxy]acetate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC=C(C=C2)/C=C\3/C(=O)N(C(=O)S3)CC4=CC=C(C=C4)F

DOS

IR

Vibrations