Geometry & MOs

Info

ID:

214923

PubChem CID:

85083858

Reduced:

SN5O7C32H43 (1)

Stoich.:

AB5C7D32E43 (1)

Weight, g/mol:

641.430491

ΔHf, kcal/mol:

-276.62

Dipole, Da:

3.5

IP(EA), eV:

 -8.83(-0.13)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-[1-[3-[3-[[1-[(4-methoxypyridin-3-yl)methyl]piperidin-4-yl]-propylamino]propoxy]propyl]pyrrolidin-3-yl]-2,2-diphenylacetamide

Drug info:

PubChemData

Smile

CCOC(=O)C(CCSC)N1CCN(C(C1=O)CC2=CC=CC=C2)C(=O)CNC(=O)C(C)NC(=O)C(CC3=CC=C(C=C3)O)N

DOS

IR

Vibrations