Acetic acid;manganese(2+);5,10,15,20-tetraphenylporphyrin-22,24-diide

Catalog Number	ACM58356653-1
CAS	58356-65-3
Structure
Synonyms	Manganese(III)acetate meso-tetraphenylporphine
Molecular Weight	727.7
Molecular Formula	C46H32MnN4O2
Canonical SMILES	CC(=O)O.C1=CC=C(C=C1)C2=C3C=CC(=C(C4=NC(=C(C5=CC=C([N-]5)C(=C6C=CC2=N6)C7=CC=CC=C7)C8=CC=CC=C8)C=C4)C9=CC=CC=C9)[N-]3.[Mn+2]
InChI	InChI=1S/C44H28N4.C2H4O2.Mn/c1-5-13-29(14-6-1)41-33-21-23-35(45-33)42(30-15-7-2-8-16-30)37-25-27-39(47-37)44(32-19-11-4-12-20-32)40-28-26-38(48-40)43(31-17-9-3-10-18-31)36-24-22-34(41)46-36;1-2(3)4;/h1-28H;1H3,(H,3,4);/q-2;+2
InChI Key	UFMFSWMECMUSKE-UHFFFAOYSA-N
Appearance	Powder
Exact Mass	727.190569
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
Monoisotopic Mass	727.190569
Rotatable Bond Count	4
Topological Polar Surface Area	64 Ų