[Mo(NCMe)(MeC≡CMe)₂(Cp)]⊕

Formula Unicode styled:

Compound name(s):

Acetonitrile-bis(η²-but-2-yne)-(η⁵-cyclopentadienyl)-molybdenum(1+)

Central atom:

Charge on formula unit (QN):

Attached groups:

Compound type:

DOI link to literature report:

Crystal data CSD link:

Crystal data ICSD link:

Valence Number (VN) = 𝘹 + 2𝘻 :

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

Oxidation Number (ON) (Roman numerals):

Electron Number (EN) = 𝘮 + 𝘹 +2𝘭:

Bond number (BN) = 𝘹 + 𝘭 + 𝘻:

[MLXZ]𝘲 class:

[MX₁L₅]⁺

MLXZ class (ENC, equivalent neutral class):

MX₂L₄

Summary of calculated classifications:

Mo«V²C⁶O^IIE¹⁶B⁶Z⁰X¹L⁵»^⊕

Geometry:

𝘥-electron configuration = 𝘮 – VN:

d⁴

𝘥-electron configuration = 𝘮 – ON:

d⁴

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

d⁴

Attached atoms:

C₉N₁

Phase:

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

YQRGCVFHYVQIEU-UHFFFAOYSA-N