(5R,8S)-8-[3-(Aminomethyl)Phenyl]-6-Hydroxy-5-Isopropyl-3-Oxo-1-Phenyl-2,7-Dioxa-4-Aza-6-Phosphanonan-9-Oic Acid 6-Oxide

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Properties Simple | Detailed

Formula C21H27N2O7P
IUPAC Name (2s)-2-[3-(aminomethyl)phenyl]-2-[[(1r)-1-(benzyloxycarbonylamino)-2-methyl-propyl]-hydroxy-phosphoryl]oxy-acetic acid
Molecular Mass 450.422 g·mol−1
Heat of Formation -1376.8 ± 16.7 kJ·mol−1
Dipole Moment 2.95 ± 1.08 D
Volume 527.33 Å 3
Surface Area 450.42 Å 2
HOMO Energy -9.23 ± 0.55 eV
LUMO Energy -0.43 ± eV
Point Group Symmetry C1
InChIKey RTFGEFWZCFCODU-RBUKOAKNSA-N
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