2,10-Diamino-6-[2-Amino-3-(1H-Imidazol-5-Yl)Propanoyl]-5-(Hydroxymethyl)Undecanedioic Acid

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Formula C18H31N5O6
IUPAC Name (2s,5s,6r,10s)-2,10-diamino-6-[(2s)-2-amino-3-(1h-imidazol-5-yl)propanoyl]-5-(hydroxymethyl)undecanedioic acid
Molecular Mass 413.469 g·mol−1
Heat of Formation -1126.5 ± 16.7 kJ·mol−1
Dipole Moment 4.49 ± 1.08 D
Volume 514.66 Å 3
Surface Area 385.86 Å 2
HOMO Energy -9.40 ± 0.55 eV
LUMO Energy 0.32 ± eV
Point Group Symmetry C1
InChIKey NGRUVTMTINLBOI-IKSZGEOFSA-N
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