3,10-Diamino-14-Methyl-5,6,6A,6B,7,9-Hexahydro-4H-Pyrimido[4'',5'':2',3'][1,4]Diazepino[6',5':3,4]Pyrrolo[1,2-F]Pteridine-1,12-Dione

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Formula C15H16N10O2
IUPAC Name 3,10-diamino-14-methyl-5,6,6a,6b,7,9-hexahydro-4h-pyrimido[4'',5'':2',3'][1,4]diazepino[6',5':3,4]pyrrolo[1,2-f]pteridine-1,12-dione
Molecular Mass 368.353 g·mol−1
Heat of Formation 1891.2 ± 16.7 kJ·mol−1
Dipole Moment 9.77 ± 1.08 D
Volume 361.33 Å 3
Surface Area 323.18 Å 2
HOMO Energy -9.64 ± 0.55 eV
LUMO Energy -4.41 ± eV
Point Group Symmetry C1
InChIKey YQZKTYLJVUNTLT-NTSWFWBYSA-N
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