4-[(R)-Amino-(4-Azido-2-Nitro-Phenyl)Methyl]-5-(Hydroxymethyl)-2-Methyl-Pyridin-1-Ium-5-Id-3-Ol

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Formula C14H16N6O4
IUPAC Name 4-[(r)-amino-(4-azido-2-nitro-phenyl)methyl]-5-(hydroxymethyl)-2-methyl-pyridin-1-ium-5-id-3-ol
Molecular Mass 332.315 g·mol−1
Heat of Formation 149.1 ± 16.7 kJ·mol−1
Dipole Moment 5.39 ± 1.08 D
Volume 363.22 Å 3
Surface Area 315.57 Å 2
HOMO Energy -9.63 ± 0.55 eV
LUMO Energy -1.77 ± eV
Point Group Symmetry C1
InChIKey ZEHDQSYNTLJOHS-CYBMUJFWSA-N
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