Geometry & MOs

Info

ID:	219431
PubChem CID:	85148657
Reduced:	RuCl2S2N3C17H25 (1)
Stoich.:	AB2C2D3E17F25 (1)
Weight, g/mol:	507.207944
ΔH_f, kcal/mol:	132.53
Dipole, Da:	3.35
IP(EA), eV:	-8.34(-2.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[5-[3-[2-ethoxy-4-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)phenoxy]propoxy]-2,3-dihydro-1H-inden-1-yl]acetic acid

Drug info:

PubChemData

Smile

CC(=NNC(=S)SC)C1=CC=CC=N1.C1CC=CCCC=C1.Cl.Cl.[Ru+2]

DOS

IR

Vibrations