1-Chloro-8-(3-Heptyl-2-Oxiranyl)-4,6-Octadiyne-2,3-Diol

Molecule SVG Image

Properties Simple | Detailed

Formula C17H25ClO3
IUPAC Name (2r,3r)-1-chloro-8-[(2r,3r)-3-heptyloxiran-2-yl]octa-4,6-diyne-2,3-diol
Molecular Mass 312.832 g·mol−1
Heat of Formation -233.5 ± 16.7 kJ·mol−1
Dipole Moment 2.13 ± 1.08 D
Volume 401.4 Å 3
Surface Area 334.34 Å 2
HOMO Energy -10.04 ± 0.55 eV
LUMO Energy 2.81 ± eV
Point Group Symmetry C1
InChIKey BPRJTLAULHNDLP-NCOADZHNSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O Cl