Geometry & MOs

Info

ID:

200941

PubChem CID:

79465504

Reduced:

NO2F3C9H16 (1)

Stoich.:

AB2C3D9E16 (1)

Weight, g/mol:

233.177964

ΔHf, kcal/mol:

-274.52

Dipole, Da:

2.58

IP(EA), eV:

-9.55(0.12)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

3-[(2,5-dimethylphenyl)methoxy]cyclohexan-1-amine

Drug info:

PubChemData

Smile

C1CC(CC(C1)OCCOC(F)(F)F)N

DOS

IR

Vibrations