3-Bromo-3-Methyl-2-((2-Nitrophenyl)Thio)-3H-Indole

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Properties Simple | Detailed

Formula C15H11BrN2O2S
IUPAC Name (3r)-3-bromo-3-methyl-2-(2-nitrophenyl)sulfanyl-indole
Molecular Mass 363.229 g·mol−1
Heat of Formation 315.4 ± 16.7 kJ·mol−1
Dipole Moment 5.00 ± 1.08 D
Volume 350.77 Å 3
Surface Area 303.83 Å 2
HOMO Energy -8.98 ± 0.55 eV
LUMO Energy 1.68 ± eV
Point Group Symmetry C1
InChIKey BXTVQNYQYUTQAZ-OAHLLOKOSA-N
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Elements C H O N S Br