10.14469/HPC/4641
Henry Rzepa
0000-0002-8635-8390
Imperial College London
Imperial College London
Imperial College Research Computing Service
Henry Rzepa
0000-0002-8635-8390
Imperial College London
Gaussian Calculation
OC: TS5 C-Cl cleavage to form carbene in the presence of di-isopropyl amine -1837.101534
Imperial College London
2018
2018-08-23 06:31:34.855950
2019-10-14 13:18:29.090953
https://data.hpc.imperial.ac.uk/resolve/?ore=4641
https://data.hpc.imperial.ac.uk/resolve/?doi=4641&file=1
https://data.hpc.imperial.ac.uk/resolve/?doi=4641&file=2
https://data.hpc.imperial.ac.uk/resolve/?doi=4641&file=3
https://data.hpc.imperial.ac.uk/resolve/?doi=4641&file=4
https://data.hpc.imperial.ac.uk/resolve/?doi=4641&file=5
10.14469/hpc/4642
-1837.101534
InChI=1S/C7H4N2O4.C7H12N.C6H15N.Cl.H2O/c1-5-2-3-6(8(10)11)4-7(5)9(12)13;1-2-5-8-6-3-4-7-8;1-5(2)7-6(3)4;;/h1-4H;2,5H,1,3-4,6-7H2;5-7H,1-4H3;;1H2
LUELQQNJBKRIKC-UHFFFAOYSA-N
Creative Commons: Public Domain Dedication 1.0
Results