2-({[2-({(3S,4S)-4-[(6-Amino-4-Methyl-2-Pyridinyl)Methyl]-3-Pyrrolidinyl}Oxy)Ethyl]Amino}Methyl)Phenol

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Formula C20H28N4O2
IUPAC Name 2-[[2-[(3s,4s)-4-[(6-amino-4-methyl-2-pyridyl)methyl]pyrrolidin-3-yl]oxyethylamino]methyl]phenol
Molecular Mass 356.462 g·mol−1
Heat of Formation -212.4 ± 16.7 kJ·mol−1
Dipole Moment 1.89 ± 1.08 D
Volume 455.3 Å 3
Surface Area 396.17 Å 2
HOMO Energy -8.69 ± 0.55 eV
LUMO Energy -0.07 ± eV
Point Group Symmetry C1
InChIKey YLQFJYDIDCSGLP-QFBILLFUSA-N
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