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	hartrees
Energy at 0K	-234.859804
Energy at 298.15K	-234.862554
Nuclear repulsion energy	52.232365

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3019	2908	35.39
2	A₁	1174	1131	53.40
3	A₁	510	491	7.05
4	E	3147	3031	13.43
4	E	3147	3031	13.43
5	E	1495	1440	0.00
5	E	1495	1440	0.00
6	E	675	650	102.51
6	E	675	650	102.51

Atom	x (Å)	y (Å)	z (Å)
Cu1	0.000	0.000	0.491
C2	0.000	0.000	-1.468
H3	0.000	1.050	-1.810
H4	0.909	-0.525	-1.810
H5	-0.909	-0.525	-1.810

	Cu1	C2	H3	H4	H5
Cu1		1.9584	2.5287	2.5287	2.5287
C2	1.9584		1.1042	1.1042	1.1042
H3	2.5287	1.1042		1.8184	1.8184
H4	2.5287	1.1042	1.8184		1.8184
H5	2.5287	1.1042	1.8184	1.8184

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Cu1	C2	H3	108.051	Cu1	C2	H4	108.051
Cu1	C2	H5	108.051	H3	C2	H4	110.854
H3	C2	H5	110.854	H4	C2	H5	110.854

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

using model chemistry: MP2/LANL2DZ

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: MP2/LANL2DZ

States and conformations

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