3-{1-Hydroxy-2-[Methyl(2-Nitrobenzyl)Amino]Ethyl}Phenol

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Properties Simple | Detailed

Formula C16H18N2O4
IUPAC Name 3-[(1r)-1-hydroxy-2-[methyl-[(2-nitrophenyl)methyl]amino]ethyl]phenol
Molecular Mass 302.325 g·mol−1
Heat of Formation -208.1 ± 16.7 kJ·mol−1
Dipole Moment 3.85 ± 1.08 D
Volume 358.93 Å 3
Surface Area 321.16 Å 2
HOMO Energy -9.20 ± 0.55 eV
LUMO Energy -1.55 ± eV
Point Group Symmetry C1
InChIKey FTHNMXWULMHUGX-INIZCTEOSA-N
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