Geometry & MOs

Info

ID:

312902

PubChem CID:

126609617

Reduced:

FSO5C16H25 (1)

Stoich.:

ABC5D16E25 (1)

Weight, g/mol:

1671.84132

ΔHf, kcal/mol:

-311.01

Dipole, Da:

4.62

IP(EA), eV:

-10.46(-0.04)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-(furan-2-ylmethylamino)-3-[4-[2-[4-[3-[4-[2-[4-[3-[4-[2-[4-[3-[4-[2-[4-[3-[4-[2-[4-[3-(furan-2-ylmethylamino)-2-hydroxypropoxy]phenyl]propan-2-yl]phenoxy]-2-hydroxypropoxy]phenyl]propan-2-yl]phenoxy]-2-hydroxypropoxy]phenyl]propan-2-yl]phenoxy]-2-hydroxypropoxy]phenyl]propan-2-yl]phenoxy]-2-hydroxypropoxy]phenyl]propan-2-yl]phenoxy]propan-2-ol

Drug info:

PubChemData

Smile

C1C2CC3CC1CC(C2)(C3)C(=O)OCCC(CCS(=O)(=O)O)F

DOS

IR

Vibrations