This form generates a site-specific cif file to incorporate in your final reports.

JHU Site-Specific Cif File

Laboratory Information

Name:

Lab:

Phone:

Email:

Source Information

Sample from:

Chemist:

Chemist's Phone Number:

Chemist's E-mail:

X-Ray ID:

X-Ray lab book page:

Chemist lab book page:

Crystallization Solvents: (check all that apply)
Acetonitrile DMF Heptane Methylene Chloride THF
n-Butanol Ethanol Hexane Octanol Toluene
Chloroform Ether Isopropanol Pentane Water
Diethyl Ether Ethyl Acetate Methanol Pyridine


Crystallization Method:
Evaporation Layering Vapor Diffusion High Temperature Hydrothermal Solvothermal Solid State

Generator and Detector Information

Generator Voltage:
60kV
55kV
50kV
45kV
40kV
Other (please specify: )

Generator Amperage:
40mA
35mA
32mA
30mA
Other (please specify: )

Goniometer Geometry:
Kappa Four Circle Chi Three Circle Platform Phi Spindle

Diffractometer:
Xcalibur3 Xcalibur2 KappaCCD SMART Apex Other SMART Other (please specify: )

Detector Distance: mm
Data Collection Temperature (in Kelvin, no units):

Overall Quality Factor

1. Strong Dataset, no disorder, R1 4% maximum. Publishable quality.
2. Good data set, perhaps some minor disorder, R1 6% maximum. Publishable quality
3. Average data set and/or easily modeled disorder or twinning. Publishable with care.
4. Weak data and/or major disorder or twinning that is not easily modeled. Publishable in some cases.
5. Very weak data and/or unexplained features of data or model. Not of publishable quality.