Geometry & MOs

Info

ID:

446206

PubChem CID:

135273133

Reduced:

N4O5C33H34 (1)

Stoich.:

A4B5C33D34 (1)

Weight, g/mol:

566.289306

ΔHf, kcal/mol:

47.21

Dipole, Da:

16.16

IP(EA), eV:

 -8.51(-1.84)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

3-[18-(2-carboxyethyl)-8,13-bis(ethenyl)-3,7,12,17-tetramethyl-2,3,12,13,22,24-hexahydroporphyrin-2-yl]propanoic acid

Drug info:

PubChemData

Smile

CCC1C(C2=NC1=CC3=C(C4=C(N3)C(=C5[C@@H]([C@H](C(=N5)C=C6C(=C(C(=C2)N6)C=C)C)C)CCC(=O)O)C(=O)OC4=O)C)C

DOS

IR

Vibrations