WUP

5,15-Diphenylporphyrin containing FE

Created:	2017-05-17
Last modified:	2017-12-06

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2 entries where WUP is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	57
Chiral Atom Count	0
Bond Count	66
Aromatic Bond Count	17

2D diagram of WUP

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Chemical Component Summary
Name	5,15-Diphenylporphyrin containing FE
Formula	C₃₂ H₂₀ Fe N₄
Molecular Weight	516.373
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	[Fe]1n2c3ccc2C(=C4C=CC(=N4)C=C5C=CC(=C(c6ccccc6)C7=NC(=C3)C=C7)[N]15)c8ccccc8
SMILES	OpenEye OEToolkits	2.0.6	c1ccc(cc1)C2=C3C=CC4=[N]3[Fe]56n7c2ccc7C=C8[N]5=C(C=C8)C(=C9N6C(=C4)C=C9)c1ccccc1
Canonical SMILES	CACTVS	3.385	[Fe]1n2c3ccc2C(=C4C=CC(=N4)C=C5C=CC(=C(c6ccccc6)C7=NC(=C3)C=C7)[N@@]15)c8ccccc8
Canonical SMILES	OpenEye OEToolkits	2.0.6	c1ccc(cc1)C2=C3C=CC4=[N]3[Fe]56n7c2ccc7C=C8[N]5=C(C=C8)C(=C9N6C(=C4)C=C9)c1ccccc1
InChI	InChI	1.03	InChI=1S/C32H20N4.Fe/c1-3-7-21(8-4-1)31-27-15-11-23(33-27)19-25-13-17-29(35-25)32(22-9-5-2-6-10-22)30-18-14-26(36-30)20-24-12-16-28(31)34-24;/h1-20H;/q-2;+2/b23-19-,24-20-,25-19-,26-20-,31-27-,31-28-,32-29-,32-30-;
InChIKey	InChI	1.03	XDBKRUAANNGFRW-RIEOGESVSA-N

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