6-[(2S)-3-Amino-2-{5-[2-(6-Amino-4-Methyl-2-Pyridinyl)Ethyl]-3-Pyridinyl}Propyl]-4-Methyl-2-Pyridinamine

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Properties Simple | Detailed

Formula C22H28N6
IUPAC Name 6-[2-[5-[(1s)-1-(aminomethyl)-2-(6-amino-4-methyl-2-pyridyl)ethyl]-3-pyridyl]ethyl]-4-methyl-pyridin-2-amine
Molecular Mass 376.498 g·mol−1
Heat of Formation 181.2 ± 16.7 kJ·mol−1
Dipole Moment 4.68 ± 1.08 D
Volume 481.73 Å 3
Surface Area 428.51 Å 2
HOMO Energy -8.77 ± 0.55 eV
LUMO Energy 2.87 ± eV
Point Group Symmetry C1
InChIKey HKLFDCGBVFYQPQ-QGZVFWFLSA-N
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Elements H C N