Geometry & MOs

Info

ID:

215105

PubChem CID:

85084161

Reduced:

IF2N3O3C34H40 (1)

Stoich.:

AB2C3D3E34F40 (1)

Weight, g/mol:

702.223898

ΔHf, kcal/mol:

-153.25

Dipole, Da:

4.12

IP(EA), eV:

 -9.22(-0.88)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-[3-[3-[[2-chloro-3-(trifluoromethyl)phenyl]methyl-(2,2-diphenylethyl)amino]-2-hydroxypropoxy]phenyl]-1-morpholin-4-ylethanone;hydrochloride

Drug info:

PubChemData

Smile

CCCN(CCC)C(=O)C1=CC(=CC(=C1)C)C(=O)OC(CNC2(CC2)C3=CC(=CC=C3)I)C(CC4=CC(=CC(=C4)F)F)N

DOS

IR

Vibrations