Please use ChatGPT to explore the computational chemistry knowledge
Construct the following molecules with Cartesian coordinates and Internal coordinates
CO2 |
Acetylene | Methane | phosphorus pentachloride | Chromium hexacarbonyl |
O 0.0 0.0 0.0 C 0.0 0.0 1.23 O 0.0 0.0 2.46 |
H 0.0 0.0 0.0 C 1.09 0.0 0.0 C 2.30 0.0 0.0 H 3.39 0.0 0.0 |
C 0.00 0.00 0.00 H 0.63 0.63 0.63 H -0.63 -0.63 0.63 H -0.63 0.63 -0.63 H 0.63 -0.63 -0.63 |
P 1.75 1.01 2.14 Cl 1.75 3.03 2.14 Cl 1.75 1.01 4.28 Cl 1.75 1.01 0.0 Cl 3.50 0.0 2.14 Cl 0.0 0.0 2.14 |
Cr 2.23 2.22 0.00 |
Methane | phosphorus pentachlorid | Ethane | trans-1,2-Dichloroethene | Formaldehyde |
C |
P
A1=2.0261 |
C C 1 T1 H 1 T2 2 T3 H 1 T2 2 T3 3 120.0 H 1 T2 2 T3 3 -120.0 H 2 T2 1 T3 3 180.0 H 2 T2 1 T3 6 120.0 H 2 T2 1 T3 6 -120.0
T1=1.5274 T2=1.0856 T3=111.2065 |
C B1 1.309000000 |
O C 1 B1 H 2 B2 1 B3 H 2 B2 1 B3 3 180.0
B1=1.1843 B2=1.0916 B3=122.16 |