β-(ET)₂I₃

Conditions

Material	β-(ET)₂I₃
Temperature	Ambient
Pressure	Ambient

Parameters

a	6.615 Å	α	94.38 °
b	9.100 Å	β	95.59 °
c	15.286 Å	γ	109.78 °
Volume		855.863 Å³

Symmetry

Cell setting	Triclinic
Spacegroup	P -1
# Symmetry ops.	2

3D Crystal Structure

Color

Model

Display

Molecule # 1
Molecule # 2
Molecule # 3
Molecule # 4
Molecule # 5
Molecule # 6

Molecule # 7
Molecule # 8
Molecule # 9

2D Electronic Structure

Filling used: 0.750

Band path
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6-311G

2D Crystal Structure

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Associated measurements (41)