7-(3-Chloro-2-Hydroxypropyl)-2'-Deoxy-7-Hydroguanosine

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Properties Simple | Detailed

Formula C13H19ClN5O5+
IUPAC Name (7s)-2-amino-7-[(2s)-3-chloro-2-hydroxy-propyl]-9-[(2r,4s,5r)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-3,8-dihydropurin-1-ium-8-id-6-one
Molecular Mass 360.773 g·mol−1
Heat of Formation 863.1 ± 16.7 kJ·mol−1
Dipole Moment 14.60 ± 1.08 D
Volume 349.88 Å 3
Surface Area 315.2 Å 2
HOMO Energy -9.20 ± 0.55 eV
LUMO Energy -2.21 ± eV
Point Group Symmetry C1
InChIKey ZZRJGNBCAVAWAM-BZNPZCIMSA-O
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Elements C N O Cl