Geometry & MOs

Info

ID:	395123
PubChem CID:	135024692
Reduced:	OSH18C29 (1)
Stoich.:	ABC18D29 (1)
Weight, g/mol:	519.883929
ΔH_f, kcal/mol:	133.97
Dipole, Da:	4.29
IP(EA), eV:	-8.68(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dichloro-[[5-(1,1,2,2,3,3,3-heptafluoropropylsulfanyl)-2-propan-2-yloxyphenyl]methylidene]ruthenium

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C#CC2=CC=C(C=C2)/C=C/C(=O)C3=CC4=C(C=C3)SC5=CC=CC=C54

DOS

IR

Vibrations