 |
N2O : Summary
Code 
|
N2O
|
One-letter code
|
X
|
Molecule name
|
NITROUS OXIDE
|
Synonyms
|
NITROGEN OXIDE
|
Systematic names
|
|
Formula
|
N2 O
|
Formal charge
|
0
|
Molecular weight
|
44.013 Da
|
SMILES
|
| Type | Program | Version | Descriptor |
|---|
|
SMILES
|
ACDLabs |
10.04 |
[O-][N+]#N |
|
SMILES
|
CACTVS |
3.341 |
[O-][N+]#N |
|
SMILES
|
OpenEye OEToolkits |
1.5.0 |
N#[N+][O-] |
|
Canonical SMILES
|
CACTVS |
3.341 |
[O-][N+]#N |
|
Canonical SMILES
|
OpenEye OEToolkits |
1.5.0 |
N#[N+][O-] |
|
IUPAC InChI | InChI=1S/N2O/c1-2-3 |
IUPAC InChI key | GQPLMRYTRLFLPF-UHFFFAOYSA-N |
|
wwPDB Information |
Atom count
|
3 (3 without Hydrogen)
|
Polymer type
|
Bound ligand
|
Type description
|
NON-POLYMER
|
Type code
|
HETAIN
|
Is modified
|
No
|
Standard parent
|
Not Assigned
|
Defined at
|
2006-09-20
|
Last modified at
|
2021-03-01
|
Status
|
Released
|
Obsoleted
|
Not Assigned
|
|
|
N2O : Atoms of Molecule
Total Number of Atoms: 3
| Record |
Atom Name |
Symbol |
PDB Name |
Stereochemistry |
Is Aromatic |
Is Leaving Atom |
Charge |
X-Coordinate |
Y-Coordinate |
Z-Coordinate |
| 1 |
O3 |
O |
O3 |
N |
N |
N |
-1 |
12.637 |
-11.994 |
-7.613 |
| 2 |
N2 |
N |
N2 |
N |
N |
N |
1 |
11.488 |
-12.816 |
-7.703 |
| 3 |
N1 |
N |
N1 |
N |
N |
N |
0 |
10.606 |
-13.448 |
-7.772 |
N2O : Chemical Bonds
Total Number of Bonds: 2
| Record |
First Atom |
Second Atom |
First Element |
Second Element |
Bond Order Type |
Bond Length |
Bond Stereochemistry |
Is Aromatic |
| 1 |
O3 |
N2 |
O |
N |
sing |
1.42 |
N |
N |
| 2 |
N2 |
N1 |
N |
N |
trip |
1.09 |
N |
N |
N2O : Used in PDB Entries
Total Number of PDB Entries: 17
|
Protein Data Bank 
