2-(N-Benzylanilino)Ethyl (4S)-5-(5,5-Dimethyl-2-Oxo-1,3,2Λ5-Dioxaphosphinan-2-Yl)-2,6-Dimethyl-4-(3-Nitrophenyl)-1,4-Dihydropyridine-3-Carboxylate

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Formula C34H38N3O7P
IUPAC Name 2-(n-benzylanilino)ethyl (4s)-5-(5,5-dimethyl-2-oxo-1,3,2λ5-dioxaphosphinan-2-yl)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate
Molecular Mass 631.655 g·mol−1
Heat of Formation -876.7 ± 16.7 kJ·mol−1
Dipole Moment 3.27 ± 1.08 D
Volume 732.57 Å 3
Surface Area 497.57 Å 2
HOMO Energy -8.29 ± 0.55 eV
LUMO Energy -1.18 ± eV
Point Group Symmetry C1
InChIKey BIPCQZVXUWYSDD-HKBQPEDESA-N
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