N-(Adamantan-1-Ylcarbonyl)-O-(2-Bromophenyl)Tyrosine

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Properties Simple | Detailed

Formula C26H28BrNO4
IUPAC Name n-(adamantan-1-ylcarbonyl)-o-(2-bromophenyl)tyrosine
Molecular Mass 498.409 g·mol−1
Heat of Formation 3351.9 ± 16.7 kJ·mol−1
Dipole Moment 11.91 ± 1.08 D
Volume 531.21 Å 3
Surface Area 418.5 Å 2
HOMO Energy -8.18 ± 0.55 eV
LUMO Energy -3.98 ± eV
Point Group Symmetry C1
InChIKey SJHUUZUNPUEALW-PAPGBOOZSA-N
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Elements C O Br N