Rutledge 1
Nicole Rutledge
Chemistry 1211 Manning
MWF 1:00-1:50pm
Spartan Project
Molecule
Empirical
Formula and
molar mass
Hydrogen
H2
Molar mass:
2.0158 amu
Oxygen
O2
Molar mass:
31.998 amu
Nitrogen
N2
Molar mass:
28.014 amu
Fluorine
F2
Molar mass:
37.996 amu
Wate r
H2O
Molar mass:
18.015 amu
Ammonia
NH3
Molar mass:
17.031 amu
2D Structure
3D Structure
Dipole Moment
and a relevant
bond distance
and bond angle
Bond distance
= .738 Å
Bond Angle
= 0°
Dipole Moment
= 0.00 Debye
Bond Distance
= 1.170 Å
Bond Angle
= 0°
Dipole Moment
= 0.00 Debye
Bond Distance
= 1.130 Å
Bond Angle
= 0°
Dipole Moment
= 0.00 Debye
Bond Distance
= 1.412 Å
Bond Angle
= 0°
Dipole Moment
= 0.00 Debye
Bond Distance
(H1, O1)
= .958 Å
Bond Angle
(H2, O1, H1)
= 105.00°
Dipole Moment
= 1.74 Debye
Bond Distance
(H2, N1)
= 1.012 Å
Bond Angle
(H2, N1, H3)
= 120.00°
Dipole Moment
=0.00 Debye
Rutledge 2
Chlorine
Cl 2
Molar mass:
70.906 amu
Ammonium
NH4 +
Molar mass:
18.039 amu
Carbon Dioxide
CO2
Molar mass:
44.010 amu
Hydrogen
Sulfide
H2S
Molar mass:
34.082 amu
Hydrochloric
Acid
H2O + HCl
Molar mass:
54.476 amu
Hydrofluoric
Acid
H2O + HF
Molar mass:
38.021 amu
Bond Distance
= 1.988 Å
Bond Angle
= 0°
Dipole Moment
= 0.00 Debye
Bond Distance
(H1, N1)
= 1.012 Å
Bond Angle
(H1, N1, H2)
= 109.47°
Dipole Moment
= 0.00 Debye
Bond Distance
(O1, C1)
= 1.410 Å
Bond Angle
(O1, C1, O2)
= 180.00°
Dipole Moment
= 0.00 Debye
Bond Distance
(H1, S1)
= 1.336 Å
Bond Angle
(H1, S1, H2)
= 91.74°
Dipole Moment
= 1.78 Debye
Bond Distance
(Cl1, H1)
=1.285 Å
Bond Angle
(H2, O1, H3)
= 108.39°
Dipole Moment
=3.68 Debye
Bond Distance
(H1, F1)
= 0.949 Å
Bond Angle
(H3, O1, H2)
= 110.32°
Dipole Moment
= 1.49 Debye
Rutledge 3
Sodium ion
(Na+)- and
chloride (Cl-)
ions – NaCl –
but made form
2 ions
NaCl
Molar Mass:
58.443 amu
Li ion (Li+) –
and chloride
(Cl-) ions – LiCl
– but made
form 2 ions
LiCl
Molar Mass:
42.394 amu
Potassium ion
(K+) – and
chloride (Cl-)
ions – KCl – but
made form 2
ions
KCl
Molar Mass:
74.551 amu
Potassium ion
(K+) – and
hydroxide(OH-)
ions – KOH –
but made form
2 ions
KOH
Molar Mass:
56.1056 amu
Sodium ion
(Na+) – and
hydroxide(OH)
ions – NaOH –
but made form
2 ions
NaOH
Molar Mass:
39.997 amu
Methane
CH4
Molar Mass:
16.043 amu
Bond Distance
(Cl1, Na1)
= 1.732 Å
Bond Angle
= 0°
Dipole Moment
= 0.00 Debye
Bond Distance
(Cl1, Li1)
= 1.732 Å
Bond Angle
= 0°
Dipole Moment
= 0.00 Debye
Bond Distance
(Cl1, K1)
= 1.732 Å
Bond Angle
= 0°
Dipole Moment
= 0.00 Debye
Bond Distance
(H1, K1)
= 1.757 Å
Bond Angle
(O1, H1, K1)
= 126.38°
Dipole Moment
= 0.00 Debye
Bond Distance
(Na1, O1)
= 2.052 Å
Bond Angle
(Na1, O1, H1)
= 179.97°
Dipole Moment
= 6.02 Debye
Bond Distance
(H1, C1)
= 1.096 Å
Bond Angle
(H1, C1, H2)
= 109.47°
Dipole Moment
= 0.00 Debye
Rutledge 4
Ethane
C2H6
Molar Mass:
30.070 amu
Bond Distance
(C1, C2)
= 1.531 Å
Bond Angle
(H4, C1, H3)
= 109.47°
Dipole Moment
= 0.00 Debye
Propane
C3H8
Molar Mass:
44.096 amu
Methanol
CH3OH
Molar Mass:
32.042 amu
Bond Distance
(H4, C1)
= 1.096 Å
Bond Angle
(H4, C1, H3)
= 109.47°
Dipole Moment
= 0.00 Debye
Bond Distance
(O1, C1)
= 1.410 Å
Bond Angle
(H4, C1, O1)
= 109.47°
Dipole Moment
= 1.49 Debye
Ethanol
C2H6 O
Molar Mass:
46.069 amu
Benzene
(hint on right
under “Rings”
is benzene)
C6H6
Molar Mass:
78.112 amu
Bond Distance
(C1, H1)
= 1.096 Å
Bond Angle
(H6, O1, C2)
= 105.00°
Dipole Moment
=1.56 Debye
Bond Distance
(C1, C6)
= 1.386 Å
Bond Angle
(H6, C6, C1)
= 120.00°
Dipole Moment
= 0.00 Debye
Rutledge 5
Peptide
((uppe r right)
and make
penta-glycine
(select gly five
times). GLY is
glycine the
amino acid. (do
not use semiempirical; select
molecular
mechanics))
Nucleotide
(sequence you
pick 25 base
pairs), select
DNA (single
strand) and “A”
helix. Be sure to
reduce its size.
(can you see
helix
structure?). run
under
molecular
mechanics.
(Gly-gly-glygly-gly)
Molar Mass:
287.276 amu
Bond Distance
(GLY3\CA, GLY3\N)
= 1.454 Å
Bond Angle
(GLY3\CA, GLY3\C,
GLY3\O)
= 121.68°
Dipole Moment
= 15.36 Debye
(A-G-T-C-A-G-TC-A-G-T-C-C-TG-A-C-T-G-A-CT-G-A-A)
Molar Mass:
15274.669 amu
Bond Distance
(A25\C4, A25\N3)
= 1.350 Å
Bond Angle
(A25\O1P, A25\P,
A25\O5*)
= 109.58°
Dipole Moment
= 69.69 Debye