return to home page Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
You are here: FAQ Help > List > Geometry > Bonds types

Bonds types in CCCBDB

All species with C:C bond.

Species Name List all bonds Experimental data
C3H3+ cyclopropenyl cation List all bonds Experimental data
C5H5 cyclopentadienyl radical List all bonds Experimental data
C6H5 phenyl List all bonds Experimental data
C6H5- phenyl anion List all bonds Experimental data
C6H6 Benzene List all bonds Experimental data
C6H6+ Benzene cation List all bonds Experimental data
C4H4N2 1,3-Diazine List all bonds Experimental data
C4H4N2 Pyrazine List all bonds Experimental data
C4H4N2 Pyridazine List all bonds Experimental data
C5H5N Pyridine List all bonds Experimental data
C5H6N+ Pyridinium List all bonds Experimental data
C6H5CH2 benzyl radical List all bonds Experimental data
C6H5CH3 toluene List all bonds Experimental data
C6H7N 2-Methylpyridine List all bonds Experimental data
C6H5NH2 aniline List all bonds Experimental data
C6H5O phenoxy radical List all bonds Experimental data
C5H5NO 2-Pyridinol List all bonds Experimental data
C5H5NO 3-Pyridinol List all bonds Experimental data
C5H5NO 4-Pyridinol List all bonds Experimental data
C6H5OH phenol List all bonds Experimental data
C6H5SH Benzenethiol List all bonds Experimental data
C6H5F Fluorobenzene List all bonds Experimental data
C6H5Cl chlorobenzene List all bonds Experimental data
C6H5Br bromobenzene List all bonds Experimental data
C6H5CCH phenylacetylene List all bonds Experimental data
C8H6 benzocyclobutadiene List all bonds Experimental data
C6H5CHCH2 Styrene List all bonds Experimental data
C6H5CH2CH3 Ethylbenzene List all bonds Experimental data
CH3C6H4CH3 meta-xylene List all bonds Experimental data
CH3C6H4CH3 paraxylene List all bonds Experimental data
C6H5CN phenyl cyanide List all bonds Experimental data
C6H5CHO benzaldehyde List all bonds Experimental data
C6H5OCH3 Anisole List all bonds Experimental data
C6H4F2 metadifluorobenzene List all bonds Experimental data
C6H4F2 orthodifluorobenzene List all bonds Experimental data
C6H4F2 1,4-difluorobenzene List all bonds Experimental data
C6H4Cl2 1,2-dichlorobenzene List all bonds Experimental data
C6H4Cl2 1,3-dichlorobenzene List all bonds Experimental data
C6H4Cl2 1,4-dichlorobenzene List all bonds Experimental data
C6H5NO nitrosobenzene List all bonds Experimental data
C9H8 Indene List all bonds Experimental data
C9H12 n-propyl benzene List all bonds Experimental data
C5H4N4 purine List all bonds Experimental data
C8H7N Indole List all bonds Experimental data
C6H5NO2 Nitrobenzene List all bonds Experimental data
C6H5COOH benzoic acid List all bonds Experimental data
CH3COC6H5 acetophenone List all bonds Experimental data
C6H3F3 Benzene trifluoride 123 List all bonds Experimental data
C10H8 Azulene List all bonds Experimental data
C10H8 naphthalene List all bonds Experimental data
Fe(C5H5)2 ferrocene List all bonds Experimental data
C12H8 Acenaphthylene List all bonds Experimental data
C12H8 biphenylene List all bonds Experimental data
C12H10 biphenyl List all bonds Experimental data
C6F6 hexafluorobenzene List all bonds Experimental data
C13H10 Fluorene List all bonds Experimental data
C14H10 Anthracene List all bonds Experimental data
C14H10 Phenanthrene List all bonds Experimental data
C14H14 Bibenzyl List all bonds Experimental data
C12H10N2 azobenzene List all bonds Experimental data
C6H5COC6H5 benzophenone List all bonds Experimental data
C16H10 Pyrene List all bonds Experimental data
C18H12 Tetracene List all bonds Experimental data
C19H16 Triphenylmethane List all bonds Experimental data
C24H12 Coronene List all bonds Experimental data