1-(2-Pyridinyl)-N-[4-(1,4,8,11-Tetraazacyclotetradecan-1-Ylmethyl)Benzyl]Methanamine

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Properties Simple | Detailed

Formula C24H38N6
IUPAC Name n-(2-pyridylmethyl)-1-[4-[[(1s)-1,4,8,11-tetrazacyclotetradec-1-yl]methyl]phenyl]methanamine
Molecular Mass 410.599 g·mol−1
Heat of Formation 222.3 ± 16.7 kJ·mol−1
Dipole Moment 4.11 ± 1.08 D
Volume 546.11 Å 3
Surface Area 420.78 Å 2
HOMO Energy -8.45 ± 0.55 eV
LUMO Energy -0.11 ± eV
Point Group Symmetry C1
Synonyms
  • 2-pyridinemethanamine, n-[[3-(1,4,8,11-tetraazacyclotetradec-1-ylmethyl)phenyl]methyl]-
  • 2-pyridylmethyl-[4-(1,4,8,11-tetrazacyclotetradec-1-ylmethyl)benzyl]amine
  • amd 3465 (*hexahydrobromide*)
  • amd3465 (*hexahydrobromide*)
  • n-(pyridin-2-ylmethyl)-1-[4-(1,4,8,11-tetrazacyclotetradec-1-ylmethyl)phenyl]methanamine
CAS Number(s)
  • 185991-07-5
InChIKey CWJJHESJXJQCJA-UHFFFAOYSA-N
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