cis–[Mo(O)₂(S₂C₆H₄-κ²S)₂]³⊖

Formula Unicode styled:

Compound name(s):

dioxo-bis(benzene-1,2-diolato)-molybdenum(3-)

Central atom:

Molybdenum

Charge on formula unit (QN):

3–

Attached groups:

O (oxo X₂)

S₂C₆H₄ (benzene-1,2-dithiolato-κ²S)

Compound type:

Molecular

DOI link to literature report:

10.1007/s11426-008-0020-9

Crystal data CSD link:

xolmeq01

Crystal data ICSD link:

Valence Number (VN) = 𝘹 + 2𝘻 :

VN: 5

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

CN: 6

Oxidation Number (ON) (Roman numerals):

ON: (V)

Electron Number (EN) = 𝘮 + 𝘹 +2𝘭:

EN: 17

Bond number (BN) = 𝘹 + 𝘭 + 𝘻:

[MLXZ]𝘲 class:

[MX₈]^3-

MLXZ class (ENC, equivalent neutral class):

MX₅L₃

Summary of calculated classifications:

Mo«V⁵C⁶O^VE¹⁷B⁸Z⁰L⁰X⁸»^3⊖

Geometry:

6-coordinate: octahedron (OC-6)

Isomer label:

cis

𝘥-electron configuration = 𝘮 – VN:

d¹

𝘥-electron configuration = 𝘮 – ON:

d¹

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

d¹

Attached atoms:

O₂S₄

Phase:

Solid

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

BEQPLPRRIFWWCW-UHFFFAOYSA-J