Chemoffice Ultra Features




1) General Description

2) Product Benefit
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ChemNMR	Predict 13C and 1H NMR shifts from ChemDraw structures.

Name=Struct	Generate a ChemDraw structure by typing in systematic chemical names for most substances.

ChemProp	Predict BP, MP, Critical Temp., Critical Pressure, Gibbs Free Energy, LogP, Refractive Index, Heat of Formation, and more from a ChemDraw structure.

ChemSpec	Enables you to import JCAMP and SPC spectral data files into ChemDraw.

ClipArt	Publication-quality EPS glassware art for use within your ChemDraw documents.

MOPAC Pro	Fujitsu’s new MOPAC, available now through Chem3D’s easy graphical interface. Calculate transition state geometries and physical properties using AM1, PM3, MNDO, MINDO/3, and new MINDO/d.

Gaussian Client	Adds Gaussian 98W calculations to Chem3D with a direct client interface (note: Gaussian 98W required).

ChemDraw/Excel	Use ChemFinder as an extension of MS Excel for Windows to create structure searchable spreadsheets with embedded ChemDraw and Chem3D application.

AutoNom	Beilstein's highly regarded AutoNom 2.1 program to generate IUPAC-standard names from ChemDraw structures is now included with ChemDraw Ultra.

CombiChem	Use ChemFinder for MS Excel to build combinatorial libraries with embedded ChemDraw structures.

GAMESS Client	Adds GAMESS calculations to Chem3D with a direct client interface (note: user must obtain GAMESS separately).

CLogP	CLogP property server for Windows provides the latest methodology for calculating n-octanol/water partition coefficients.

ChemSAR	ChemSAR is a Chem3D Windows add-in for MS Excel with descriptive statistics and plots for structure-activity relationships.

E-Notebook	Record your lab journal with structures on your Windows machine. Search over structures and perform chemical calculations on them.

ChemFinder/Word	Use ChemFinder as an extension of MS Excel and Word for Windows to create structure searchable spreadsheets and documents with an embedded ChemDraw application.

Stereochemistry	Identifies stereo centers using Cahn-Ingold Prelog rules.

Online Menu	Draw a structure or model and immediately get online vendor information for e-commerce purchase from ChemACX.Com with the click of a button.

Structure Cleanup	Improves poor drawings.

Multi-Page Docs	Create multiple page documents and posters within a single ChemDraw file.

Peak-Struct NMR Correlation	Correlates atoms with NMR peaks.

Conformer Std	Conformational modeling with a limited version of Princeton Simulation's Conformer.

Table Editor	Edit atom property tables used in calculations.

Name=Struct/Excel	Generate a ChemDraw structure in MS Excel by typing in systematic chemical names for most substances.


4) Databases

5) System Requirements