5-Phosphono-1,2,3,4-Tetrahydro-3-Isoquinolinecarboxylic Acid

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Properties Simple | Detailed

Formula C10H12NO5P
IUPAC Name (3s)-5-phosphono-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid
Molecular Mass 257.180 g·mol−1
Heat of Formation -1065.6 ± 16.7 kJ·mol−1
Dipole Moment 1.45 ± 1.08 D
Volume 272.63 Å 3
Surface Area 250.86 Å 2
HOMO Energy -9.70 ± 0.55 eV
LUMO Energy -0.56 ± eV
Point Group Symmetry C1
InChIKey VRDCPZSTZJNJOF-QMMMGPOBSA-N
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