Formula Unicode styled:
[Ca(NCS-κN)₂(Pentaglyme)-κ⁶O]
Compound name(s):
(2,5,8,11,14,17-Hexaoxaoctadecane-O,O',O'',O''',O'''',O''''')-bis(isothiocyanato)-calcium
Central atom:
Charge on formula unit (QN):
0
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:
8
[MLXZ]𝘲 class:
[MX2L6]
MLXZ class (ENC, equivalent neutral class):
MX2L6
Summary of calculated classifications:
Ca«V2C8OIIE16B8Z0X2L6»
Geometry:
𝘥-electron configuration = 𝘮 – VN:
𝘥-electron configuration = 𝘮 – ON:
𝘥-electron configuration = 𝘮 – VN – 𝘲 from [MLXZ]𝘲:
Attached atoms:
N2O6
Phase:
InChIKey (see www.inchi-trust.org):
WWRWWPBLDJXSRE-UHFFFAOYSA-N