National Institute of Standards and Technology
Computational Chemistry Comparison and Benchmark DataBase
Release 18October 2016
NIST Standard Reference Database 101
IIntroduction
IIExperimental data
IIICalculated data
IVData comparisons
VCost comparisons
VIInput and output files
VIITutorials and Units
VIIILinks to other sites
IXFeedback
XOlder CCCBDB versions
XIIGeometries
XIII Vibrations
XIVReaction data
XVEntropy data
XVIBibliographic data
XVIIIon data
XVIIIBad calculations
XIXIndex of properties
XXH-bond dimers
XXIOddities

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II.B.4. (XII.A.4.)

Experimental descriptions of bond angles with experimental data.

This table lists coordinate descriptions and how many of that type of angle are in the CCCBDB. Click on the description for a more detailed list. The angles are listed with the first atom having the smallest atomic number. For example: an angle involving C-C-H atoms will be listed under aHCC.
descriptionCount descriptionCount descriptionCount descriptionCount
aBBCl 1 aBBF 1 aBHB 1 aBNB 1
aBrCBr 3 aBrPBr 1 aCCBr 1 aCCC 217
aCCCl 39 aCCF 22 aCCH 8 aCCN 27
aCCO 67 aCCS 16 aClAlCl 2 aClAsCl 1
aClBCl 2 aClCBr 2 aClCCl 15 aClGeCl 1
aClNaCl 1 aClOCl 1 aClPCl 2 aClSCl 3
aClSiCl 5 aCNC 18 aCNN 6 aCNO 6
aCOC 20 aCOCl 1 aCOF 1 aCON 7
aCOO 2 aCSC 12 aCSiC 1 aCSiCl 1
aCSiH 1 aCSO 2 aCSS 1 aDSD 1
aFBF 3 aFBrF 3 aFCBr 3 aFCCl 6
aFCF 22 aFCI 1 aFClF 5 aFClO 1
aFCO 2 aFNF 3 aFNO 1 aFOF 1
aFPF 2 aFSCl 1 aFSF 11 aFSiF 3
aHAlH 1 aHAsH 1 aHBCl 1 aHBeH 1
aHBF 1 aHBH 4 aHBN 2 aHBS 1
aHCBr 6 aHCC 253 aHCCl 9 aHCF 13
aHCGe 1 aHCH 193 aHCI 1 aHCN 30
aHCO 33 aHCP 4 aHCS 23 aHCSe 2
aHCSi 4 aHCZn 1 aHFF 2 aHGeC 1
aHGeH 2 aHNB 2 aHNC 17 aHNH 11
aHNN 5 aHNO 2 aHOBr 1 aHOC 17
aHOCl 2 aHOF 1 aHOH 2 aHOLi 1
aHOMg 1 aHON 4 aHOO 3 aHOS 1
aHPC 2 aHPH 3 aHPO 1 aHPP 2
aHSC 8 aHSeC 1 aHSeH 1 aHSH 1
aHSiBr 1 aHSiC 1 aHSiCl 3 aHSiF 1
aHSiH 9 aHSiSi 1 aHSS 1 aNBN 1
aNCN 6 aNCO 7 aNNF 1 aNNO 7
aNOF 1 aOBO 1 aOCCl 2 aOCF 1
aOCH 2 aOClF 2 aOClO 6 aOCO 13
aOCS 1 aOCSe 1 aOLiO 1 aONBr 1
aONCl 2 aONF 2 aONO 23 aOOCl 1
aOOF 1 aOOO 2 aOOX 2 aOPCl 1
aOPF 1 aOPO 1 aOSCl 2 aOSeO 1
aOSF 3 aOSO 7 aOSS 1 aPPP 1
aSCS 2 aSSCl 2 aSSS 1 aXCF 1
aXNF 1 aXNH 1 aXPCl 1 aXPF 1
aXPH 1 aXSiH 1