Filociclovir

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Properties Simple | Detailed

Formula C11H13N5O3
IUPAC Name 2-amino-9-[[2,2-bis(hydroxymethyl)cyclopropylidene]methyl]-3h-purin-6-one
Molecular Mass 263.253 g·mol−1
Heat of Formation 1408.4 ± 16.7 kJ·mol−1
Dipole Moment 6.32 ± 1.08 D
Volume 285.92 Å 3
Surface Area 267.13 Å 2
HOMO Energy -9.49 ± 0.55 eV
LUMO Energy -4.74 ± eV
Point Group Symmetry C1
Synonyms
  • 2-amino-9-(2,2-bis-hydroxymethyl-cyclopropylidenemethyl)-1,9-dihydro-purin-6-one
  • 2-amino-9-[(z)-(2,2-dimethylolcyclopropylidene)methyl]-3h-purin-6-one
  • 2-amino-9-[(z)-[2,2-bis(hydroxymethyl)cyclopropylidene]methyl]-3h-purin-6-one
  • aids-165691
  • aids165691
  • cyclopropavir
  • zsm-i-62
InChIKey KMUNHOKTIVSFRA-KXFIGUGUSA-N
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