(6R,7S)-6,7-Bis(4-Bromophenyl)-2,12-Dimethyl-7,12-Dihydro-6H-Chromeno[4,3-D][1,2,4]Triazolo[1,5-A]Pyrimidine

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Formula C26H20Br2N4O
IUPAC Name (6r,7s)-6,7-bis(4-bromophenyl)-2,12-dimethyl-7,12-dihydro-6h-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Molecular Mass 564.271 g·mol−1
Heat of Formation 470.0 ± 16.7 kJ·mol−1
Dipole Moment 4.61 ± 1.08 D
Volume 542.69 Å 3
Surface Area 418.41 Å 2
HOMO Energy -8.90 ± 0.55 eV
LUMO Energy -0.94 ± eV
Point Group Symmetry C1
InChIKey YVBPVLXAHZCKBM-UKILVPOCSA-N
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Elements H C O Br N