Geometry & MOs

Info

ID:

446948

PubChem CID:

135279033

Reduced:

SF2N3H25C26 (1)

Stoich.:

AB2C3D25E26 (1)

Weight, g/mol:

652.523782

ΔHf, kcal/mol:

0.09

Dipole, Da:

3.66

IP(EA), eV:

-8.4(-0.36)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-N-tert-butyl-2-methyl-2-N-[2-[2-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-1-N-[2-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]ethyl]propane-1,2-diamine

Drug info:

PubChemData

Smile

CCSNC1=C(C=C(C(=C1)C2=C3C=CNC3=NC(=C2)C)CC4=C(C=C(C=C4)F)F)C5CC5

DOS

IR

Vibrations