Geometry & MOs

Info

ID:

176516

PubChem CID:

76061787

Reduced:

N2O3H6C15 (1)

Stoich.:

A2B3C6D15 (1)

Weight, g/mol:

742.369013

ΔHf, kcal/mol:

24.41

Dipole, Da:

2.68

IP(EA), eV:

 -10.26(-3.16)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

3-[10-[2-(2-aminopropanoylamino)propanoyl]-18-(2-carboxyethyl)-8,13-bis(1-hydroxyethyl)-3,7,12,17-tetramethyl-21,22,23,24-tetrahydroporphyrin-2-yl]propanoic acid

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C3=NC(=O)N=C4C3=C(C2=O)C(=O)C=C4

DOS

IR

Vibrations