DFT optimized geometries

Hanzevacki, Marko

Description

XYZ coordinates of Metoclopramide (neutral and cation) and its intermediates and photoproducts.

Citations (0)

Mentions (0)

Metrics

Dataset Index

0.6

FAIR Score

85%

Citations

0

Mentions

0

Metrics Over Time

Publication Details

DOI

Publisher

figshare

License

Creative Commons Attribution 4.0 International

Assigned Domain

Subfield

Materials Chemistry

Field

Materials Science

Domain

Physical Sciences

Confidence Score

49%

Source

Open Alex

Keywords

Computational Chemistry

Normalization Factors

FT

50.00

CTw

1.00

MTw

1.00