(4R)-4-{Hydroxy[N~5~-(N-Nitrocarbamimidoyl)-L-Ornithyl]Amino}-L-Prolinamide

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Formula C11H22N8O5
IUPAC Name (2s,4r)-4-[[(2s)-2-amino-5-[(e)-[amino(nitramido)methylene]amino]pentanoyl]-hydroxy-amino]pyrrolidine-2-carboxamide
Molecular Mass 346.343 g·mol−1
Heat of Formation -341.3 ± 16.7 kJ·mol−1
Dipole Moment 4.55 ± 1.08 D
Volume 399.36 Å 3
Surface Area 362.37 Å 2
HOMO Energy -9.53 ± 0.55 eV
LUMO Energy 2.09 ± eV
Point Group Symmetry C1
Synonyms
  • (2s,4r)-4-[[(2s)-2-amino-5-[(amino-nitramido-methylene)amino]pentanoyl]-hydroxy-amino]pyrrolidine-2-carboxamide
  • (2s,4r)-4-[[(2s)-2-amino-5-[(amino-nitramido-methylidene)amino]pentanoyl]-hydroxy-amino]pyrrolidine-2-carboxamide
  • (2s,4r)-4-[[(2s)-2-amino-5-[(amino-nitramidomethylene)amino]-1-oxopentyl]-hydroxyamino]-2-pyrrolidinecarboxamide
  • 4hx
InChIKey CTHMJCQUZVLLJU-CSMHCCOUSA-N
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