(3,4-Dihydroxyphenyl)(Hydroxy)Acetonitrile

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Properties Simple | Detailed

Formula C8H7NO3
IUPAC Name (2r)-2-(3,4-dihydroxyphenyl)-2-hydroxy-acetonitrile
Molecular Mass 165.146 g·mol−1
Heat of Formation -313.7 ± 16.7 kJ·mol−1
Dipole Moment 4.09 ± 1.08 D
Volume 189.28 Å 3
Surface Area 189.74 Å 2
HOMO Energy -9.16 ± 0.55 eV
LUMO Energy -0.65 ± eV
Point Group Symmetry C1
InChIKey CRISWXPNFWRXSH-MRVPVSSYSA-N
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