(+)-Anthramycin

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Properties Simple | Detailed

Formula C16H17N3O4
IUPAC Name (e)-3-[(6s,6as)-4,6-dihydroxy-3-methyl-11-oxo-5,6,6a,7-tetrahydropyrrolo[2,1-c][1,4]benzodiazepin-8-yl]prop-2-enamide
Molecular Mass 315.324 g·mol−1
Heat of Formation -517.1 ± 16.7 kJ·mol−1
Dipole Moment 9.59 ± 1.08 D
Volume 359.55 Å 3
Surface Area 321.91 Å 2
HOMO Energy -8.68 ± 0.55 eV
LUMO Energy 2.09 ± eV
Point Group Symmetry C1
InChIKey VGQOVCHZGQWAOI-HYUHUPJXSA-N
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