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Basic Information
CAS No.: 12008-06-9
Name: GADOLINIUM BORIDE
Article Data: 12
Molecular Structure:
Molecular Structure of 12008-06-9 (GADOLINIUM BORIDE)
Formula: GdB6
Molecular Weight: 222.116
Synonyms: Gadoliniumboride (GdB6) (6CI,8CI);Gadolinium hexaboride;Gadolinium hexaboride (GdB6);
EINECS: 234-530-0
Density: 5.27
Melting Point: > 2100oC.
Appearance: purple powder
PSA: 0.00000
LogP: -1.18390
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Specification

The Gadolinium boride (GdB6), (OC-6-11)-, with the CAS registry number 12008-06-9, is also known as Gadolinium hexaboride (GdB6). And its EINECS registry number is 234-530-0. This chemical's molecular formula is B6Gd and molecular weight is 222.116. In addition, it must be stored in airtight containers and placed in a dry, cool place.

Physical properties about Gadolinium boride (GdB6), (OC-6-11)- are: (1)H-Bond Donor: 0; (2)H-Bond Acceptor: 2; (3)Rotatable Bond Count: 0; (4)Exact Mass: 222.983565; (5)MonoIsotopic Mass: 223.979934; (6)Topological Polar Surface Area: 0; (7)Heavy Atom Count: 7; (8)Formal Charge: 0; (9)Complexity: 132; (10)Isotope Atom Count: 0; (11)Defined Atom StereoCenter Count: 0; (12)Undefined Atom StereoCenter Count: 0; (13)Defined Bond StereoCenter Count: 0; (14)Undefined Bond StereoCenter Count: 0; (15)Covalently-Bonded Unit Count: 2.

You can still convert the following datas into molecular structure:
(1) SMILES: [Gd+2].B13B4[B-]12B5B2[B-]345
(2) InChI: InChI=1/B6.Gd/c1-2-5(1)3-4(5)6(1,2)3;/q-2;+2
(3) InChIKey: FYKPSYVUFHLGOY-UHFFFAOYAF