Geometry & MOs

Info

ID:

66232

PubChem CID:

46500469

Reduced:

NO2F3H18C20 (1)

Stoich.:

AB2C3D18E20 (1)

Weight, g/mol:

375.144613

ΔHf, kcal/mol:

-182.76

Dipole, Da:

7.83

IP(EA), eV:

-8.98(-0.8)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2,2,2-trifluoro-1-[2-methyl-1-[3-(4-methylphenoxy)propyl]indol-3-yl]ethanone

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)OCCN2C(=C(C3=CC=CC=C32)C(=O)C(F)(F)F)C

DOS

IR

Vibrations