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Abstract:
Phenanthroline derivative, 4,5-diazafluoren-9-one(dafone), was introduced into lead iodine hybrid to synthesize a new hybrid [Pb-2[(4)(dafone)(2)]n (1), in which each lead atom adopts a distorted octahedral coordination and presents a one-dimensional polymer by edge-sharing mode. Due to the presence of O acceptor in dafone, C-H center dot center dot center dot O hydrogen bonds can be observed and contribute to the formation of 2-D layer. Experimental and theoretical optical property investigation indicate that 1 possesses semiconductor property. Specially, DFT calculation suggests that 1 displays a reduced band gap (1.36 eV), which is assigned to a more dispersed LUMO band compared with [Pb2I4(phen)(2)](n). and [Pb2I4(bipy)(2)](n) (C) 2010 Elsevier B.V. All rights reserved.
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JOURNAL OF MOLECULAR STRUCTURE
ISSN: 0022-2860
Year: 2010
Issue: 1-3
Volume: 982
Page: 28-32
1 . 5 9 9
JCR@2010
4 . 0 0 0
JCR@2023
ESI Discipline: CHEMISTRY;
JCR Journal Grade:3
CAS Journal Grade:4
Cited Count:
WoS CC Cited Count: 3
SCOPUS Cited Count:
ESI Highly Cited Papers on the List: 0 Unfold All
WanFang Cited Count:
Chinese Cited Count:
30 Days PV: 2
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