Geometry & MOs

Info

ID:

146787

PubChem CID:

53750340

Reduced:

N2O3H28C37 (1)

Stoich.:

A2B3C28D37 (1)

Weight, g/mol:

506.300539

ΔHf, kcal/mol:

76.27

Dipole, Da:

3.23

IP(EA), eV:

 -8.92(-0.43)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-amino-N-[(2R)-1-[[(2R)-1-[dimethylamino(methyl)amino]-1-oxo-3-phenylpropan-2-yl]-methylamino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-2-methylpropanamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)OC2=CC=C(C=C2)C(C3=CN=CC=C3)C(=O)C(C4=CC=C(C=C4)OC5=CC=CC=C5)C6=CN=CC=C6

DOS

IR

Vibrations