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15418-29-8 | Tetrakis(acetonitrile)copper(I) tetrafluoroborate
CAS No: 15418-29-8 Catalog No: AG003UPN MDL No:MFCD09265110
Product Description
Catalog Number:
AG003UPN
Chemical Name:
Tetrakis(acetonitrile)copper(I) tetrafluoroborate
CAS Number:
15418-29-8
Molecular Formula:
C8H12BCuF4N4
Molecular Weight:
314.5583
MDL Number:
MFCD09265110
IUPAC Name:
acetonitrile;copper(1+);tetrafluoroborate
InChI:
InChI=1S/4C2H3N.BF4.Cu/c4*1-2-3;2-1(3,4)5;/h4*1H3;;/q;;;;-1;+1
InChI Key:
YZGSKMIIVMCEFE-UHFFFAOYSA-N
SMILES:
F[B-](F)(F)F.CC#N.CC#N.CC#N.CC#N.[Cu+]
Properties
Complexity:
48.4
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
6
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
314.039g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
314.562g/mol
Monoisotopic Mass:
314.039g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
95.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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