2-[2-(4-Amino-3,5-Dichlorophenyl)-4-(2,3,4-Trimethoxybenzyl)-1-Piperazinyl]Ethanol

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Properties Simple | Detailed

Formula C22H29Cl2N3O4
IUPAC Name 2-[(1s,2r,4r)-2-(4-amino-3,5-dichloro-phenyl)-4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]ethanol
Molecular Mass 470.389 g·mol−1
Heat of Formation -480.5 ± 16.7 kJ·mol−1
Dipole Moment 2.00 ± 1.08 D
Volume 549.01 Å 3
Surface Area 460.29 Å 2
HOMO Energy -8.62 ± 0.55 eV
LUMO Energy -0.32 ± eV
Point Group Symmetry C1
InChIKey NRSMPGVRFPRKNI-SFHVURJKSA-N
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Elements H C N O Cl