5-[4-(4-Nitrophenyl)Piperazin-1-Yl]-5-(4-Phenylphenyl)Hexahydropyrimidine-2,4,6-Trione

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Formula C26H23N5O5
IUPAC Name 5-[4-(4-nitrophenyl)piperazin-1-yl]-5-(4-phenylphenyl)hexahydropyrimidine-2,4,6-trione
Molecular Mass 485.491 g·mol−1
Heat of Formation -165.7 ± 16.7 kJ·mol−1
Dipole Moment 9.12 ± 1.08 D
Volume 543.3 Å 3
Surface Area 456.14 Å 2
HOMO Energy -8.79 ± 0.55 eV
LUMO Energy 2.05 ± eV
Point Group Symmetry C1
InChIKey PAXRRXXNAWMMER-UHFFFAOYSA-N
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