Batzelline D

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Properties Simple | Detailed

Formula C10H7ClN2O2
IUPAC Name batzelline d
Molecular Mass 222.628 g·mol−1
Heat of Formation -91.8 ± 16.7 kJ·mol−1
Dipole Moment 9.43 ± 1.08 D
Volume 225.33 Å 3
Surface Area 213.23 Å 2
HOMO Energy -8.74 ± 0.55 eV
LUMO Energy -1.32 ± eV
Point Group Symmetry C1
Synonyms
  • pyrrolo[4,3,2-de]quinoline-7,8-dione, 6-chloro-1,3,4,5-tetrahydro-
InChIKey OACZASFROFWUOT-UHFFFAOYSA-N
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Elements H C N O Cl