FAIR data for Octet expansion and hypervalence in dimethylidyne-λ6-sulfane.

DOI: 10.14469/hpc/3333 Metadata

Created: 2017-11-28 18:18

Last modified: 2018-01-02 07:41

Author: Henry Rzepa

License: Creative Commons: Public Domain Dedication 1.0

Funding: (none given)

Description

I started this story by looking at octet expansion and hypervalence in non-polar hypercoordinate species such as SMe6, then moved to S(CH2)3. Finally now its the turn of HC≡S≡CH.

Member of collection / collaboration

DOIDescription
10.14469/hpc/3268 Hyper-chemistry: -valency, -bonds, -coordination and -data (FAIR).

Members

DOIDescription
10.14469/hpc/3423 HCCrCH NBO
10.14469/hpc/3424 HCCrCH WFN
10.14469/hpc/3331 HCSCH Wiberg
10.14469/hpc/3336 HCCCH WFN
10.14469/hpc/3334 HCSCH CAS(14,14)
10.14469/hpc/3306 S(CH)2 WFN
10.14469/hpc/3330 Linear HCSCH WFN
10.14469/hpc/3339 HCBeCH Wiberg
10.14469/hpc/3338 HCBeCH WFN
10.14469/hpc/3341 HCBeCH CASSCF(12,12) WFN
10.14469/hpc/3447 MeCrCrMe (quintuple Cr-Cr bond)
10.14469/hpc/3448 MeCrCrMe (quintuple Cr-Cr bond) WFN
10.14469/hpc/3552 HCClCH (+) linear WFN
10.14469/hpc/3553 HCPCH (-) WFN
10.14469/hpc/3554 HCAr(2+)CH linear WFN
10.14469/hpc/3555 MeCSCMe NBO
10.14469/hpc/3556 MeCSCMe WFN
10.14469/hpc/3557 MeCAr(2+)CMe linear WFN

Associated DOIs

Current dataset ...DOIDescription
References 10.14469/hpc/3335 Octet expansion and hypervalence in dimethylidyne-λ6-sulfane.

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