Geometry & MOs

Info

ID:

170568

PubChem CID:

75253635

Reduced:

FO4N6C28H35 (1)

Stoich.:

AB4C6D28E35 (1)

Weight, g/mol:

688.367636

ΔHf, kcal/mol:

-119.71

Dipole, Da:

5.25

IP(EA), eV:

 -8.66(-0.7)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

5-(4-fluorophenyl)-1-[2-[6-[(2-methylpropan-2-yl)oxy]-4-phenylmethoxyoxan-2-yl]ethyl]-N,4-diphenyl-2-propan-2-ylpyrrole-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)OC(=O)N1CCC(CC1)OC(C)C2=NC(=NO2)C3=CN=C(C=C3)N4CC(C(C4)N)C5=CC=CC=C5F

DOS

IR

Vibrations