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1414869-95-6

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1414869-95-6 Structure

1414869-95-6 Structure
IdentificationBack Directory
[Name]

NH2-MIL-101(Cr)
[CAS]

1414869-95-6
[Synonyms]

NH2-MIL-101(Cr)
[Molecular Formula]

C24H17Cr3FN3O15
[MOL File]

1414869-95-6.mol
[Molecular Weight]

762.39
Chemical PropertiesBack Directory
[InChI]

InChI=1S/3C8H7NO4.3Cr.FH.2H2O.O/c3*9-6-3-4(7(10)11)1-2-5(6)8(12)13;;;;;;;/h3*1-3H,9H2,(H,10,11)(H,12,13);;;;1H;2*1H2;/q;;;+3;2*+4;;;;-2/p-9
[InChIKey]

AASGLQFIKRZMKA-UHFFFAOYSA-E
[SMILES]

[F-][Cr+3]12O=C(C3C=CC(C(=O)[O-])=CC=3N)[O-][Cr+3]3(O=C(C4C=CC(C(=O)[O-])=CC=4N)[O-][Cr+3](O=C(C4C=CC(C(=O)[O-])=CC=4N)[O-]1)(O)[O-2]23)O
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