Geometry & MOs

Info

ID:

125639

PubChem CID:

50930793

Reduced:

O2C21H38 (1)

Stoich.:

A2B21C38 (1)

Weight, g/mol:

1023.702713

ΔHf, kcal/mol:

-126.46

Dipole, Da:

1.83

IP(EA), eV:

 -10.29(0.79)

Spin(Sz, S2):

 None, None

Charge, e:

 2

Chem-info

IUPAC name:

magnesium;[(E)-3,7,11,15-tetramethylhexadec-2-enyl] 3-[18-(dibutylcarbamoyl)-8-ethenyl-13-ethyl-20-(2-methoxy-2-oxoethyl)-3,7,12,17-tetramethyl-2,3,22,23-tetrahydroporphyrin-2-yl]propanoate

Drug info:

PubChemData

Smile

CCCCCC[C@@H]1C[C@@H]1[C@@H]2C[C@H]2CCCCCCCC(=O)OC

DOS

IR

Vibrations