10.14469/HPC/4308
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
Product, TS214b, 353 b3lyp+gd3bj/6-311++G(d,p) -933.596264
Imperial College London
2018
2018-05-29 08:51:34.881550
2019-10-14 13:12:28.005502
https://data.hpc.imperial.ac.uk/resolve/?ore=4308
https://data.hpc.imperial.ac.uk/resolve/?doi=4308&file=1
https://data.hpc.imperial.ac.uk/resolve/?doi=4308&file=2
https://data.hpc.imperial.ac.uk/resolve/?doi=4308&file=3
https://data.hpc.imperial.ac.uk/resolve/?doi=4308&file=4
https://data.hpc.imperial.ac.uk/resolve/?doi=4308&file=5
10.14469/hpc/4326
InChI=1S/C16H15NO2.N2/c1-19-16(18)14-7-9-15(10-8-14)17-12-11-13-5-3-2-4-6-13;1-2/h2-10,12H,11H2,1H3;/b17-12+;
InChI=1S/C16H15N3O2/c1-21-16(20)13-7-9-14(10-8-13)18-15(22-19-17)11-12-5-3-2-4-6-12/h2-10H,11H2,1H3/b18-15-
KUNIEQAWKUXIEZ-SDXDJHTJSA-N
FLFAIZWJNGQAPR-KCUXUEJTSA-N
Creative Commons: Public Domain Dedication 1.0
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