2,7-Diamino-4,9-Dihydroxy-5,10-Dioxo-4,5,9,10-Tetrahydro-4,9-Diazapyrene

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Properties Simple | Detailed

Formula C14H10N4O4
IUPAC Name 6,13-diamino-2,9-dihydroxy-2,9-diazatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4(16),5,7,11(15),12-hexaene-3,10-dione
Molecular Mass 298.254 g·mol−1
Heat of Formation -206.3 ± 16.7 kJ·mol−1
Dipole Moment 0.93 ± 1.08 D
Volume 304.46 Å 3
Surface Area 274.68 Å 2
HOMO Energy -8.08 ± 0.55 eV
LUMO Energy -1.53 ± eV
Point Group Symmetry C2
Synonyms
  • 2,7-diamino-4,9-dihydro-4,9-dihydroxypyrido(2,3,4,5-lmn)phenanthridine-5,10-dione
  • pyrido(2,3,4,5-lmn)phenanthridine-5,10-dione, 2,7-diamino-4,9-dihydro-4,9-dihydroxy-
CAS Number(s)
  • 58996-11-5
InChIKey HCBUDRIKLCCMEY-UHFFFAOYSA-N
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