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	hartrees
Energy at 0K	-1678.772321
Energy at 298.15K	-1678.775249
Nuclear repulsion energy	80.155323

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	3097	2908
2	A₁	1121	1052
3	A₁	738	693
4	E	3209	3013
4	E	3205	3009
5	E	1482	1392
5	E	1476	1386
6	E	733	688
6	E	729	685

Atom	x (Å)	y (Å)	z (Å)
Cu1	0.000	0.000	0.452
C2	0.000	0.000	-1.351
H3	0.000	1.042	-1.671
H4	0.902	-0.521	-1.671
H5	-0.902	-0.521	-1.671

	Cu1	C2	H3	H4	H5
Cu1		1.8030	2.3649	2.3649	2.3649
C2	1.8030		1.0898	1.0898	1.0898
H3	2.3649	1.0898		1.8043	1.8043
H4	2.3649	1.0898	1.8043		1.8043
H5	2.3649	1.0898	1.8043	1.8043

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Cu1	C2	H3	107.084	Cu1	C2	H4	107.084
Cu1	C2	H5	107.084	H3	C2	H4	111.750
H3	C2	H5	111.750	H4	C2	H5	111.750

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

using model chemistry: QCISD(T)/6-31+G**

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: QCISD(T)/6-31+G**

States and conformations

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