Formula Unicode styled:
[Zr(Cl)₃{η⁵-C₅H₃(Buᵗ)₂}]
Compound name(s):
(η⁵-1,3-Di-t-butyl-cyclopentadienyl)-trichloro-zirconium
Central atom:
Charge on formula unit (QN):
0
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:
6
[MLXZ]𝘲 class:
[MX4L2]
MLXZ class (ENC, equivalent neutral class):
MX4L2
Summary of calculated classifications:
Zr«V4C6OIVE12B6Z0X4L2»
Geometry:
𝘥-electron configuration = 𝘮 – VN:
d0
𝘥-electron configuration = 𝘮 – ON:
d10
𝘥-electron configuration = 𝘮 – VN – 𝘲 from [MLXZ]𝘲:
d0
Attached atoms:
C5Cl3
Phase:
InChIKey (see www.inchi-trust.org):
XDJHPRUXRLKSPX-UHFFFAOYSA-K