Geometry & MOs

Info

ID:

25999

PubChem CID:

635461

Reduced:

CoH25C33 (1)

Stoich.:

AB25C33 (1)

Weight, g/mol:

540.392708

ΔHf, kcal/mol:

218.85

Dipole, Da:

17.28

IP(EA), eV:

 -9.86(-4.88)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

dimethyl 1,5-dimethyl-6-(6-methylheptan-2-yl)-17,18-diazapentacyclo[11.8.0.02,10.05,9.015,20]henicosa-16,19-diene-16,19-dicarboxylate

Drug info:

PubChemData

Smile

[CH-]1[CH-][CH-][CH-][CH-]1.C1=CC=C(C=C1)[C-]2[C-]([C-]([C-]2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5.[Co]

DOS

IR

Vibrations