Constituent Pyrene | SSHADE

Constituent

Name: Pyrene
Official name: Pyrene

Family: molecular solid
Class: mixed molecular solid
Compound type: organic molecular solid

Constituent abundance in material

Relevance: main - major
Arrangement: single phase
Mass: 0.3 $\pm$ 0.001 $g$
Mass fraction: 0.945 $\pm$ 0.03
Mole fraction: 1.0
Abundance comments: Purity by GC-FID (97.5%) and by HPLC UV-254nm (91.6%). The impurities are not specified

Chemical composition

Formula: $C_{16}H_{10}$
Chemical formula: C16H10
Elemental formula: C16 H10
Isotope mixture type: terrestrial abundance

	Formula	Name	Family	Number min-max	Mole fraction	Isotope mole fraction	State	Relevance
	$C_{16}H_{10}$	Pyrene	molecule	1	1.0	1.0	pure	main

Chemical functions and bonds

Chemical functions

	Function	Number	Relevance
	$R=CH-R$	10	main

Chemical bonds

	Bond	Number	Relevance
	$\eqslantgtr C-H$	10	main
	$\eqslantgtr C-C\eqslantless$	11	main
	$>C=C<$	8	main

Class: molecular solids with apolar molecules (01)

Phase type: crystalline

Crystallography

Crystal system: monoclinic
Crystal class: prismatic
Crystal class symbol: 2/m (C2h)
Crystal spacegroup: P2(1)/c

Physical properties

Molar mass: 202.26 $g/mol$
Density: 1.271 $g/cm^3$

Optical properties

Color: yellow