CCCBDB listing of experimental data page 2

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Bond Type	Count
C-C	4
C=C	3
H-C	7

Atom 1	Atom 2
C1	C2
C1	C7
C1	H8
C2	C3
C2	H9
C3	C4
C3	H10
C4	C5
C4	H11
C5	C6
C5	H12
C6	C7
C6	H13
C7	H14

State	Config	State description	Conf description	Exp. min.	Dipole (Debye)				Reference	comment	Point Group	Components
State	Config	State description	Conf description	Exp. min.	x	y	z	total	Reference	comment	Point Group	dipole	quadrupole
1	1	²A₂	C_2v	True							C_2v	1	2
1	2	²A^"	C_s	False							C_s	2	3

State	Config	State description	Conf description	Exp. min.	Quadrupole (D Å)			Reference	comment	Point Group	Components
State	Config	State description	Conf description	Exp. min.	xx	yy	zz	Reference	comment	Point Group	dipole	quadrupole
1	1	²A₂	C_2v	True						C_2v	1	2
1	2	²A^"	C_s	False						C_s	2	3

squib	reference	DOI
2002Rie/Tsc:231	JC Rienstra-Kiracofe, GS Tschumper, HF Schaefer III, S Nandi, GB Ellison "Atomic and Molecular Electron Affinities: Photoelectron Experiments and Theoretical Computations" Chemical Reviews 2002, 102, 231-282	10.1021/cr990044u
webbook	NIST Chemistry Webbook (http://webbook.nist.gov/chemistry)	10.18434/T4D303

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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Atom 1	Atom 2
C1	C2
C1	C7
C1	H8
C2	C3
C2	H9
C3	C4
C3	H10
C4	C5
C4	H11
C5	C6
C5	H12
C6	C7
C6	H13
C7	H14

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Atom 1	Atom 2
C1	C2
C1	C7
C1	H8
C2	C3
C2	H9
C3	C4
C3	H10
C4	C5
C4	H11
C5	C6
C5	H12
C6	C7
C6	H13
C7	H14

Experimental data for C7H7+ (cycloheptatrienyl cation)

Experimental data for C₇H₇⁺ (cycloheptatrienyl cation)

Atom 1	Atom 2
C1	C2
C1	C7
C1	H8
C2	C3
C2	H9
C3	C4
C3	H10
C4	C5
C4	H11
C5	C6
C5	H12
C6	C7
C6	H13
C7	H14