H5C8NO2

H5C8NO2 is a metastable, semiconducting organic compound known for its diverse structural configurations.

CHNO
Crystal structure of H5C8NO2
Ground-state structure · Materials Project
Overview

About H5C8NO2

H5C8NO2 is a complex organic molecule characterized by its semiconducting electronic profile. Its structural diversity is evidenced by its presence in multiple distinct crystallographic arrangements, highlighting the intricate bonding possibilities within this molecular framework. Due to its position above the thermodynamic hull, this compound is considered metastable. This inherent instability makes it a subject of significant interest for researchers investigating the limits of molecular synthesis and the formation of transient organic phases.

At a glance

Key Properties

Cross-validated computational properties for H5C8NO2, aggregated across 3 databases.

Band Gap

2.90 eV
Range across DFT structures

Energy Above Hull

0.191 eV/atom
Best (lowest) across sources

Stability

Above hull
1 DFT source

Structures

11
3 databases, 3 space groups
Reference

Frequently Asked Questions

Common questions about H5C8NO2, answered from cross-validated data.

What is H5C8NO2?

H5C8NO2 is a metastable, semiconducting organic compound known for its diverse structural configurations.

More questions
What is the band gap of H5C8NO2?
H5C8NO2 has a DFT-computed band gap of 2.90 eV across 11 reported structures.
Is H5C8NO2 a metal, semiconductor, or insulator?
With a band gap up to 2.90 eV it is a semiconductor.
Is H5C8NO2 thermodynamically stable?
H5C8NO2 has a lowest energy above hull of 0.191 eV/atom (above hull).
How many polymorphs of H5C8NO2 are known?
11 structures of H5C8NO2 are reported across 3 databases, spanning 3 distinct space groups.
What elements does H5C8NO2 contain?
H5C8NO2 contains C, H, N, and O (4 elements).
Where does the data for H5C8NO2 come from?
H5C8NO2 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a unique organic molecular entity, H5C8NO2 functions as a standalone case study within its structural class, representing a specific arrangement of carbon, hydrogen, nitrogen, and oxygen that challenges conventional stability predictions.

Data sources & attribution
  • latticegraph — Lattice Graph Materials Intelligence Platform

Analyze H5C8NO2 in the Lattice Graph platform

Polymorph comparison, confidence scoring, supply-chain risk, and patent monitoring — across 53 integrated data sources.

Explore the Platform →