KEGG   COMPOUND: C18647Help
Entry
C18647                      Compound                               

Name
Calcium arsenate
Formula
Ca3(AsO4)2
Exact mass
397.6903
Mol weight
398.0724
Structure
Mol fileKCF fileDB searchJmolKegDraw
Brite
Pesticides [BR:br08007]
 Pesticides
  Insecticides
   Arsenical insecticides
    C18647  Calcium arsenate
BRITE hierarchy
Other DBs
CAS: 
7778-44-1
PubChem: 
ChEBI: 
LinkDB All DBs
KCF data Show

ATOM        13
            1   Z   As   14.9100  -15.6800
            2   O0  O    14.9100  -14.2800
            3   O1a O    16.7300  -15.6800 #-
            4   O1a O    13.5100  -15.6800 #-
            5   O1a O    14.9100  -17.1500 #-
            6   Z   Ca   20.5800  -15.7500 #2+
            7   Z   Ca   20.6413  -13.6150 #2+
            8   Z   Ca   20.7156  -17.8009 #2+
            9   Z   As   14.9100  -15.6800
            10  O0  O    14.9100  -14.2800
            11  O1a O    16.7300  -15.6800 #-
            12  O1a O    13.5100  -15.6800 #-
            13  O1a O    14.9100  -17.1500 #-
BOND        8
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     1   5 1
            5     9  10 2
            6     9  11 1
            7     9  12 1
            8     9  13 1
BRACKET     1    12.4600  -17.7800   12.4600  -13.7200
            1    17.7100  -13.7200   17.7100  -17.7800
            1  2
 ORIGINAL  1    1   2   3   4   5
 REPEAT    1    9  10  11  12  13

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