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Date Name Thumbnail Size Description Versions
19:14, 8 December 2009 CO stretches on the IR spectrum of A. (C4H6)Fe(CO)3.JPG (file) 20 KB CO_stretches_on_the_IR_spectrum_of_A._(C4H6)Fe(CO)3.JPG 1
19:13, 8 December 2009 Frontier MO diagram of (C4H4)Fe(CO)3.JPG (file) 37 KB Frontier_MO_diagram_of_(C4H4)Fe(CO)3.JPG 1
19:13, 8 December 2009 D. (C4H4)Fe(CO)3 table.JPG (file) 20 KB D._(C4H4)Fe(CO)3_table.JPG 1
19:13, 8 December 2009 D Fe(CO)3(C4H4).mol (file) 1 KB D_Fe(CO)3(C4H4).mol 1
19:11, 8 December 2009 Frontier Molecular orbitals of free cyclobutadiene.JPG (file) 35 KB Frontier_Molecular_orbitals_of_free_cyclobutadiene.JPG 1
19:10, 8 December 2009 Summary of the first part of the Mini Project.JPG (file) 42 KB Summary_of_the_first_part_of_the_Mini_Project.JPG 1
19:10, 8 December 2009 Molecular orbitals of the butadiene ligand, as obtained from computational results and as expected from MO theory..JPG (file) 71 KB Molecular_orbitals_of_the_butadiene_ligand,_as_obtained_from_computational_results_and_as_expected_from_MO_theory..JPG 1
19:09, 8 December 2009 C. (C5H5)Ta(C4H6)Cl2 table.JPG (file) 19 KB C._(C5H5)Ta(C4H6)Cl2_table.JPG 1
19:08, 8 December 2009 C (C5H5)Ta(C4H6)Cl2.mol (file) 2 KB C_(C5H5)Ta(C4H6)Cl2.mol 1
19:06, 8 December 2009 B. Fe(CO)3(C4H6) table.JPG (file) 17 KB B._Fe(CO)3(C4H6)_table.JPG 1
19:06, 8 December 2009 B Fe(CO)3(C4H6).mol (file) 2 KB B_Fe(CO)3(C4H6).mol 1
19:02, 8 December 2009 A. Rh(C4H6)2Cl table.JPG (file) 18 KB A._Rh(C4H6)2Cl_table.JPG 1
19:01, 8 December 2009 A Rh(C4H6)2Cl.mol (file) 2 KB A_Rh(C4H6)2Cl.mol 1
18:59, 8 December 2009 Optimised Butadiene and Optimised Cyclobutadiene.JPG (file) 15 KB Optimised_Butadiene_and_Optimised_Cyclobutadiene.JPG 1
18:47, 8 December 2009 Optimazation plot of BH3.jpg (file) 72 KB Optimazation_plot_of_BH3.jpg 1
18:44, 8 December 2009 Analysis of the low frequency vibtations of the cis and trans isomer.jpg (file) 42 KB Analysis_of_the_low_frequency_vibtations_of_the_cis_and_trans_isomer.jpg 1
18:40, 8 December 2009 IR spectrum of trans-Mo(CO)4(PCl3)2.jpg (file) 26 KB IR_spectrum_of_trans-Mo(CO)4(PCl3)2.jpg 1
18:40, 8 December 2009 IR spectrum of cis-Mo(CO)4(PCl3)2.jpg (file) 30 KB IR_spectrum_of_cis-Mo(CO)4(PCl3)2.jpg 1
18:39, 8 December 2009 CO vibrations of trans Mo(CO)4(PCl3)2.jpg (file) 40 KB CO_vibrations_of_trans_Mo(CO)4(PCl3)2.jpg 1
18:39, 8 December 2009 CO vibrations of cis-Mo(CO)4(PCl3)2.jpg (file) 48 KB CO_vibrations_of_cis-Mo(CO)4(PCl3)2.jpg 1
18:28, 8 December 2009 Summary of the optimisations and the frequency analysis performed for trans-Mo(CO)4(PCl3)2.jpg (file) 25 KB Summary_of_the_optimisations_and_the_frequency_analysis_performed_for_trans-Mo(CO)4(PCl3)2.jpg 1
18:27, 8 December 2009 Summary of the optimisations and frequency analyses performed for cis-Mo(CO)4(PCl3)2.jpg (file) 27 KB Summary_of_the_optimisations_and_frequency_analyses_performed_for_cis-Mo(CO)4(PCl3)2.jpg 1
18:06, 8 December 2009 Selected bond lengths (A) and angles (°) for cis- and trans-Mo(CO)4(PCl3)2.jpg (file)
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82 KB Selected_bond_lengths_(A)_and_angles_(°)_for_cis-_and_trans-Mo(CO)4(PCl3)2.jpg 1
18:02, 8 December 2009 Structures of cis- and trans-Mo(CO)4(PCl3)2.jpg (file) 14 KB Structures_of_cis-_and_trans-Mo(CO)4(PCl3)2.jpg 1
18:00, 8 December 2009 IR Spectrum of BCl3 poho.jpg (file) 18 KB IR_Spectrum_of_BCl3_poho.jpg 1
17:52, 8 December 2009 IR Spectrum of BH3 poho.jpg (file) 27 KB IR_Spectrum_of_BH3 1
17:49, 8 December 2009 Assigning symmetric to the BH3 vibrations.jpg (file) 16 KB Assigning_symmetry_to_the_BH3_vibrations.jpg 1
17:49, 8 December 2009 Character table D3h.jpg (file) 11 KB Character_table_D3h.jpg 1
17:47, 8 December 2009 MO Diagram for BH3.jpg (file) 25 KB MO_Diagram_for_BH3 1
16:49, 27 November 2009 13C NMR of 4B.jpg (file) 26 KB   1
16:46, 27 November 2009 Literature compound 4a.jpg (file) 11 KB Literature_compound_4a.jpg 1
16:07, 27 November 2009 Dihedral angles between Carbonyl group and the aromatic ring.JPG (file) 10 KB Dihedral_angles_between_Carbonyl_group_and_the_aromatic_ring.JPG 1
16:03, 27 November 2009 Computed IR stretches for molecule 12 and its exo hydrolised compound2.JPG (file) 17 KB Computed_IR_stretches_for_molecule_12_and_its_exo_hydrolised_compound2.JPG 1
16:02, 27 November 2009 Comparison of the energies of the two Cyclopentadiene Dimers and the of the Products of Hydrogenation.JPG (file) 11 KB Comparison_of_the_energies_of_the_two_Cyclopentadiene_Dimers_and_the_of_the_Products_of_Hydrogenation.JPG 1
16:01, 27 November 2009 4a isomer.mol (file) 3 KB literature compound 4a isomer 1
16:00, 27 November 2009 Literature4a.mol (file) 3 KB Literature compound 4a 1
15:58, 27 November 2009 Intermediate 10 with functionnalisation of alkene.mol (file) 4 KB functionalised intermediate 10 1
15:57, 27 November 2009 Intermediate 10.mol (file) 4 KB   1
15:55, 27 November 2009 Intermediate 9 b.mol (file) 4 KB Intermediate 9 1
15:53, 27 November 2009 Product 8.mol (file) 6 KB product 8 1
15:51, 27 November 2009 Comparison of the energies of the two Cyclopentadiene Dimers and the of the Products of Hydrogenation.bmp (file) 20 KB Comparison_of_the_energies_of_the_two_Cyclopentadiene_Dimers_and_the_of_the_Products_of_Hydrogenation.bmp 1
15:50, 27 November 2009 Reactant 7 model 1.mol (file) 4 KB reactant 7 1
15:49, 27 November 2009 Reactant 6.mol (file) 3 KB product 6 1
15:47, 27 November 2009 Reactant 5 model 1.mol (file) 3 KB derivative of prolinol (5) 1
15:24, 27 November 2009 Compound4a.cml (file) 5 KB literature compound 4a 1
14:25, 27 November 2009 LUMO+2 12.jpg (file) 31 KB LUMO+2 compound 2 1
14:23, 27 November 2009 LUMO+1 12.jpg (file) 31 KB LUMO+1 of compound 12 1
14:20, 27 November 2009 LUMO 12.jpg (file) 32 KB LUMO of compound 12 1
14:18, 27 November 2009 HOMO-1 12.jpg (file) 32 KB HOMO-1 of compound 12 1
14:14, 27 November 2009 HOMO 12.jpg (file) 33 KB HOMO of reagent 12 1
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