C5H9N3-1

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Histamine

Experimental GED + MW re structure [TikhonovPCCP2016]Author: Tikhonov, Denis S.; Rykov, Anatolii N.; Grikina, Olga E.; Khaikin, Leonid S.
Journal: Phys. Chem. Chem. Phys.
Pages: 6092-6102
Title: Gas phase equilibrium structure of histamine
Url: http://dx.doi.org/10.1039/C5CP07719B
Volume: 18
Year: 2016
Link to Google Scholar
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Tautomer N(1)H

Conformer 1G-IVa

29(3) % @ 393 K

Tautomer N(3)H

Conformer 3G-Ib

29(4) % @ 393 K

Conformer 3G-Ic

19(10) % @ 393 K

Conformer 3G-Vb

4(6) % @ 393 K

Conformer 3G-Vc

9(8) % @ 393 K

Conformer 3T-a

10(1) % @ 393 K