4-(5,7,7,10,10-Pentamethyl-7,8,9,10-Tetrahydro-5H-Benzo[E]Naphtho[2,3-B][1,4]Diazepin-13-Yl)Benzoic Acid

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Formula C29H30N2O2
IUPAC Name 4-(5,7,7,10,10-pentamethyl-8,9-dihydronaphtho[2,3-b][1,4]benzodiazepin-13-yl)benzoic acid
Molecular Mass 438.561 g·mol−1
Heat of Formation -111.0 ± 16.7 kJ·mol−1
Dipole Moment 5.89 ± 1.08 D
Volume 546.32 Å 3
Surface Area 444.77 Å 2
HOMO Energy -8.28 ± 0.55 eV
LUMO Energy -0.90 ± eV
Point Group Symmetry C1
Synonyms
  • -
  • 0
  • 1
  • 2
  • 8
  • 9
  • c
  • g
  • n
InChIKey YZZAIQOVMHVWBS-UHFFFAOYSA-N
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