Geometry & MOs

Info

ID:

331857

PubChem CID:

127250143

Reduced:

N2O2F3C21H23 (1)

Stoich.:

A2B2C3D21E23 (1)

Weight, g/mol:

378.230728

ΔHf, kcal/mol:

-211.27

Dipole, Da:

4.62

IP(EA), eV:

-9.3(-0.7)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

cyclohexyl-[2-[5-[(4-methylphenyl)methyl]pyridin-2-yl]morpholin-4-yl]methanone

Drug info:

PubChemData

Smile

CC(C)C(=O)N1CCOC(C1)C2=NC=C(C=C2)CC3=CC(=CC=C3)C(F)(F)F

DOS

IR

Vibrations