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	hartrees
Energy at 0K	-1678.638246
Energy at 298.15K	-1678.641134
Nuclear repulsion energy	79.807281

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3109	2915	18.94
2	A₁	1293	1212	115.53
3	A₁	668	626	56.80
4	E	3196	2997	6.30
4	E	3196	2997	6.30
5	E	1482	1390	1.24
5	E	1482	1390	1.24
6	E	706	662	81.81
6	E	706	662	81.81

Atom	x (Å)	y (Å)	z (Å)
Cu1	0.000	0.000	0.458
C2	0.000	0.000	-1.343
H3	0.000	1.017	-1.738
H4	0.881	-0.508	-1.738
H5	-0.881	-0.508	-1.738

	Cu1	C2	H3	H4	H5
Cu1		1.8001	2.4197	2.4197	2.4197
C2	1.8001		1.0911	1.0911	1.0911
H3	2.4197	1.0911		1.7613	1.7613
H4	2.4197	1.0911	1.7613		1.7613
H5	2.4197	1.0911	1.7613	1.7613

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Cu1	C2	H3	111.255	Cu1	C2	H4	111.255
Cu1	C2	H5	111.255	H3	C2	H4	107.631
H3	C2	H5	107.631	H4	C2	H5	107.631

All results from a given calculation for CuCH₃ (monomethyl copper)

using model chemistry: CCD/6-31G**

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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All results from a given calculation for CuCH3 (monomethyl copper)

using model chemistry: CCD/6-31G**

States and conformations

All results from a given calculation for CuCH₃ (monomethyl copper)