Mannomustine

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Properties Simple | Detailed

Formula C10H22Cl2N2O4
IUPAC Name (2r,3r,4r,5r)-1,6-bis(2-chloroethylamino)hexane-2,3,4,5-tetrol
Molecular Mass 305.199 g·mol−1
Heat of Formation -889.5 ± 16.7 kJ·mol−1
Dipole Moment 4.71 ± 1.08 D
Volume 357.07 Å 3
Surface Area 328.34 Å 2
HOMO Energy -9.53 ± 0.55 eV
LUMO Energy 0.57 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3r,4r,5r)-1,6-bis(2-chloroethylamino)hexane-2,3,4,5-tetrol
  • 1,6-bis[(2-chloroethyl)amino]-1,6-dideoxy-d-mannitol
InChIKey MQXVYODZCMMZEM-ZYUZMQFOSA-N
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Elements H C N O Cl