Geometry & MOs

Info

ID:	88273
PubChem CID:	49902714
Reduced:	BrClSN2O4H14C19 (1)
Stoich.:	ABCD2E4F14G19 (1)
Weight, g/mol:	436.005133
ΔH_f, kcal/mol:	-103.43
Dipole, Da:	4.46
IP(EA), eV:	-9.49(-1.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)Cl)CN2C(=O)/C(=C/C3=CC(=C(C=C3)OCC(=O)N)Br)/SC2=O

DOS

IR

Vibrations