Formula |
C7H13N |
IUPAC Name |
heptanenitrile |
Molecular Mass |
111.185 g·mol−1 |
Heat of Formation |
-28.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.09 ± 1.08 D |
Volume |
172.32 Å 3 |
Surface Area |
181.88 Å 2 |
HOMO Energy |
-11.43 ± 0.55 eV |
LUMO Energy |
4.22 ± eV |
Point Group Symmetry |
Cs
|
Synonyms
|
- 1-cyanohexane
- enanthonitrile
- heptane nitrile
- heptane-1-nitrile
- heptanonitrile
- hexyl cyanide
|
CAS Number(s) |
- 629-08-3
- 1885-40-1
- 73833-76-8
|
InChIKey |
SDAXRHHPNYTELL-UHFFFAOYSA-N |
QR Code |
Generate QR Code |
Links |
PubChem
ChemSpider
|
DOI |
|
Downloads |
Get JSON data
Get MOL2 data
Get SVG Image
|
Elements |
H
C
N
|
|
|