6-[3-(Adamantan-1-Yl)-4-Hydroxyphenyl]-5-Chloro-2-Naphthoic Acid

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Properties Simple | Detailed

Formula C27H25ClO3
IUPAC Name 6-[3-(1-adamantyl)-4-hydroxy-phenyl]-5-chloro-naphthalene-2-carboxylic acid
Molecular Mass 432.939 g·mol−1
Heat of Formation -447.3 ± 16.7 kJ·mol−1
Dipole Moment 2.02 ± 1.08 D
Volume 491.73 Å 3
Surface Area 407.43 Å 2
HOMO Energy -9.10 ± 0.55 eV
LUMO Energy -1.29 ± eV
Point Group Symmetry C1
InChIKey COGZYQJUYQQUPC-ULEMIGMXSA-N
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Elements H C O Cl