Theodrenaline

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Formula C17H25N5O5
IUPAC Name 7-[2-[[(2r)-2-(3,4-dihydroxyphenyl)-2-hydroxy-ethyl]amino]ethyl]-1,3-dimethyl-8h-purine-4,5,8,9-tetraide-2,6-dione
Molecular Mass 379.411 g·mol−1
Heat of Formation -655.6 ± 16.7 kJ·mol−1
Dipole Moment 6.84 ± 1.08 D
Volume 429.94 Å 3
Surface Area 316.91 Å 2
HOMO Energy -8.56 ± 0.55 eV
LUMO Energy 2.69 ± eV
Point Group Symmetry C1
InChIKey WMCMJIGLYZDKRN-ZDUSSCGKSA-N
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