Geometry & MOs

Info

ID:

409648

PubChem CID:

135082430

Reduced:

N2O3C19H25 (2)

Stoich.:

A2B3C19D25 (2)

Weight, g/mol:

614.346821

ΔHf, kcal/mol:

-280.44

Dipole, Da:

4.03

IP(EA), eV:

 -8.37(0.58)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

methyl 3-[8,13-diethyl-18-(3-methoxy-3-oxopropyl)-3,7,12,17-tetramethyl-15-oxo-10,20,21,22,23,24-hexahydro-5H-porphyrin-2-yl]propanoate

Drug info:

PubChemData

Smile

CCC1=C2CC3=C(C(=C(N3)C(C4=C(C(=C(N4)CC5=C(C(=C(N5)CC(=C1C)N2)C)CCC(=O)OC)CCC(=O)OC)C)OC(=O)C)CC)C

DOS

IR

Vibrations