CCCBDB listing of experimental data page 2

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Bond Type	Count
C:C	6
C=C	1
C-C	1
C-N	2
H-C	6
H-N	1

Atom 1	Atom 2
N1	C2
N1	C8
N1	H10
C2	C3
C2	H11
C3	C9
C3	H12
C4	C5
C4	C9
C4	H13
C5	C6
C5	H14
C6	C7
C6	H15
C7	C8
C7	H16
C8	C9

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	¹A^'	C_s	True							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	¹A^'	C_s	True						C_s	2	3

	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
N1	C2
N1	C8
N1	H10
C2	C3
C2	H11
C3	C9
C3	H12
C4	C5
C4	C9
C4	H13
C5	C6
C5	H14
C6	C7
C6	H15
C7	C8
C7	H16
C8	C9

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Atom 1	Atom 2
N1	C2
N1	C8
N1	H10
C2	C3
C2	H11
C3	C9
C3	H12
C4	C5
C4	C9
C4	H13
C5	C6
C5	H14
C6	C7
C6	H15
C7	C8
C7	H16
C8	C9

Experimental data for C8H7N (Indole)

Experimental data for C₈H₇N (Indole)

Atom 1	Atom 2
N1	C2
N1	C8
N1	H10
C2	C3
C2	H11
C3	C9
C3	H12
C4	C5
C4	C9
C4	H13
C5	C6
C5	H14
C6	C7
C6	H15
C7	C8
C7	H16
C8	C9