Geometry & MOs

Info

ID:	86940
PubChem CID:	49890059
Reduced:	FNSO6H22C23 (1)
Stoich.:	ABCD6E22F23 (1)
Weight, g/mol:	469.966161
ΔH_f, kcal/mol:	-233.49
Dipole, Da:	4.94
IP(EA), eV:	-8.71(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-chloro-2-[(Z)-[3-[(2,4-dichlorophenyl)methyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl]phenoxy]acetamide

Drug info:

PubChemData

Smile

CCOC1=C(C=CC(=C1)/C=C\2/C(=O)N(C(=O)S2)CC3=CC=C(C=C3)F)OCC(=O)OCC

DOS

IR

Vibrations