Geometry & MOs

Info

ID:

150535

PubChem CID:

53790228

Reduced:

O4C11H14 (1)

Stoich.:

A4B11C14 (1)

Weight, g/mol:

1192.874744

ΔHf, kcal/mol:

-156.96

Dipole, Da:

5.21

IP(EA), eV:

 -9.99(-0.34)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

3-[[bis[1-[3-(3,3-dipropoxypropoxy)propoxy]-3-hydroxypropyl]amino]-[1-[3-(3,3-dipropoxypropoxy)propoxy]-3-hydroxypropyl]amino]-3-[3-(3,3-dipropoxypropoxy)propoxy]propan-1-ol

Drug info:

PubChemData

Smile

CC([C@@H](C(=O)O)O)OCC1=CC=CC=C1

DOS

IR

Vibrations