Geometry & MOs

Info

ID:

202604

PubChem CID:

79697587

Reduced:

NF3C17H18 (1)

Stoich.:

AB3C17D18 (1)

Weight, g/mol:

289.123342

ΔHf, kcal/mol:

-110.23

Dipole, Da:

2.31

IP(EA), eV:

-9.13(-0.44)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

N-[(4-chloro-3-methoxyphenyl)-(4-methylphenyl)methyl]ethanamine

Drug info:

PubChemData

Smile

CCCNC(C1=CC(=CC(=C1)C)F)C2=C(C=CC=C2F)F

DOS

IR

Vibrations