cis,cis–[Ru(Cl)₂(Dmdtc)(Cp*)]

Formula Unicode styled:

Compound name(s):

dichloro-(dimethyldithiocarbamato-S,S')-(η⁵-pentamethylcyclopentadienyl)-ruthenium

Central atom:

Ruthenium

Charge on formula unit (QN):

Attached groups:

Cl (chloro)

Dmdtc (dimethyldithiocarbamato-κ²S)

Cp* (η⁵-pentamethylcyclopentadienyl)

Compound type:

Molecular

DOI link to literature report:

10.1021/om060866z

Crystal data CSD link:

weytuq

Crystal data ICSD link:

Valence Number (VN) = 𝘹 + 2𝘻 :

VN: 4

Coordination Number (CN, sum of attached group denticities):

CN: 7

Oxidation Number (ON) (Roman numerals):

ON: (IV)

Electron Number (EN) = 𝘮 + 𝘹 +2𝘭:

EN: 18

Bond number (BN) = 𝘹 + 𝘭 + 𝘻:

[MLXZ]𝘲 class:

[MX₄L₃]

MLXZ class (ENC, equivalent neutral class):

MX₄L₃

Summary of calculated classifications:

Ru«V⁴C⁷O^IVE¹⁸B⁷Z⁰X⁴L³»

Geometry:

7-coordinate: ③-●-4 piano stool

Isomer label:

cis,cis

𝘥-electron configuration = 𝘮 – VN:

d⁴

𝘥-electron configuration = 𝘮 – ON:

d⁴

𝘥-electron configuration = 𝘮 – VN – 𝘲 from [MLXZ]𝘲:

d⁴

Attached atoms:

C₅Cl₂S₂

Phase:

Solid

InChIKey (see www.inchi-trust.org):

QBBBXDCRNJSTSM-UHFFFAOYSA-J