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	hartrees
Energy at 0K	-684.056460
Energy at 298.15K	-684.061806
HF Energy	-683.802377
Nuclear repulsion energy	88.436958

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	2498	2368	64.37
2	A	2492	2362	31.40
3	A	1161	1100	12.60
4	A	900	853	0.01
5	A	678	642	7.37
6	A	459	435	0.58
7	A	213	202	2.72
8	B	2507	2376	104.40
9	B	2482	2352	20.87
10	B	1151	1091	27.57
11	B	844	800	55.23
12	B	639	605	12.51

Atom	x (Å)	y (Å)	z (Å)
P1	0.000	1.115	-0.086
P2	0.000	-1.115	-0.086
H3	-0.227	1.365	1.286
H4	1.404	1.239	0.007
H5	0.227	-1.365	1.286
H6	-1.404	-1.239	0.007

	P1	P2	H3	H4	H5	H6
P1		2.2291	1.4133	1.4125	2.8433	2.7423
P2	2.2291		2.8433	2.7423	1.4133	1.4125
H3	1.4133	2.8433		2.0759	2.7678	3.1312
H4	1.4125	2.7423	2.0759		3.1312	3.7452
H5	2.8433	1.4133	2.7678	3.1312		2.0759
H6	2.7423	1.4125	3.1312	3.7452	2.0759

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
P1	P2	H5	100.215	P1	P2	H6	95.064
P2	P1	H3	100.215	P2	P1	H4	95.064
H3	P1	H4	94.547	H5	P2	H6	94.547

All results from a given calculation for P₂H₄ (Diphosphine)

using model chemistry: MP2/TZVP

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 P2H4 (Diphosphine)

using model chemistry: MP2/TZVP

States and conformations

All results from a given calculation for P₂H₄ (Diphosphine)