4-(1,4,7,10-Tetraazacyclododecan-1-Ylmethyl)Quinoline

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Properties Simple | Detailed

Formula C18H27N5
IUPAC Name 4-(1,4,7,10-tetrazacyclododec-1-ylmethyl)quinoline
Molecular Mass 313.440 g·mol−1
Heat of Formation 249.3 ± 16.7 kJ·mol−1
Dipole Moment 2.58 ± 1.08 D
Volume 405.65 Å 3
Surface Area 317.75 Å 2
HOMO Energy -8.69 ± 0.55 eV
LUMO Energy 2.29 ± eV
Point Group Symmetry C1
InChIKey ZOBKJHWKGWGMPU-UHFFFAOYSA-N
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Elements H C N