N-[(4R)-6-(4-Chlorophenyl)-7-(2,4-Dichlorophenyl)-2,2-Dimethyl-3,4-Dihydro-2H-Pyrano[2,3-B]Pyridin-4-Yl]-5-Methyl-1H-Pyrazole-3-Carboxamide

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Properties Simple | Detailed

Formula C27H23Cl3N4O2
IUPAC Name n-[(4r)-6-(4-chlorophenyl)-7-(2,4-dichlorophenyl)-2,2-dimethyl-3,4-dihydropyrano[2,3-b]pyridin-4-yl]-5-methyl-1h-pyrazole-3-carboxamide
Molecular Mass 541.856 g·mol−1
Heat of Formation -63.3 ± 16.7 kJ·mol−1
Dipole Moment 6.42 ± 1.08 D
Volume 598.16 Å 3
Surface Area 494.35 Å 2
HOMO Energy -9.06 ± 0.55 eV
LUMO Energy 2.20 ± eV
Point Group Symmetry C1
InChIKey IDUFEEHNNASCMH-HSZRJFAPSA-N
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Elements H C N O Cl