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Details

Stereochemistry ACHIRAL
Molecular Formula C32H16N8.Cu
Molecular Weight 576.069
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PHTHALOCYANINE BLUE

SMILES

[Cu++].[N-]1C2=NC3=NC(=NC4=C5C=CC=CC5=C([N-]4)N=C6N=C(N=C1C7=C2C=CC=C7)C8=C6C=CC=C8)C9=C3C=CC=C9

InChI

InChIKey=XCJYREBRNVKWGJ-UHFFFAOYSA-N
InChI=1S/C32H16N8.Cu/c1-2-10-18-17(9-1)25-33-26(18)38-28-21-13-5-6-14-22(21)30(35-28)40-32-24-16-8-7-15-23(24)31(36-32)39-29-20-12-4-3-11-19(20)27(34-29)37-25;/h1-16H;/q-2;+2

HIDE SMILES / InChI

Molecular Formula Cu
Molecular Weight 63.546
Charge 2
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C32H18N8
Molecular Weight 514.5389
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Record UNII
3VEX9T7UT5
Record Status Validated (UNII)
Record Version