Geometry & MOs

Info

ID:

307959

PubChem CID:

125310951

Reduced:

N2C11H12 (1)

Stoich.:

A2B11C12 (1)

Weight, g/mol:

506.241687

ΔHf, kcal/mol:

69.62

Dipole, Da:

4.62

IP(EA), eV:

-8.78(-0.87)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-[[(4S)-4-ethyl-8,8-dimethyl-2-oxo-3,4,9,10-tetrahydropyrano[2,3-h]chromen-5-yl]oxy]-N-[2-(5-methoxy-2H-indol-3-yl)ethyl]acetamide

Drug info:

PubChemData

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C1CC2=C3C=CC=CC3=N[C@@H]2[C@H]1N

DOS

IR

Vibrations