N-[3-(Dimethylamino)Propyl]-N-Methyl-N'-[(1S,2R,5S,6S,7S,8R,9R)-2,6,9-Trimethyl-13-Oxatetracyclo[6.3.1.1~6,9~.0~1,5~]Tridec-7-Yl]-1,4-Butanediamine

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Formula C25H47N3O
IUPAC Name n-[3-(dimethylamino)propyl]-n-methyl-n'-[(1s,2r,5s,6s,7s,8r,9r)-2,6,9-trimethyl-13-oxatetracyclo[6.3.1.1 6,9 .0 1,5 ]tridec-7-yl]-1,4-butanediamine
Molecular Mass 405.660 g·mol−1
Heat of Formation -338.7 ± 16.7 kJ·mol−1
Dipole Moment 1.75 ± 1.08 D
Volume 565.87 Å 3
Surface Area 445.58 Å 2
HOMO Energy -8.57 ± 0.55 eV
LUMO Energy 2.65 ± eV
Point Group Symmetry C1
InChIKey JIRJLWLQLDLWSW-XNDBBLGPSA-N
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