Geometry & MOs

Info

ID:

130051

PubChem CID:

51074762

Reduced:

SO2N4C17H18 (1)

Stoich.:

AB2C4D17E18 (1)

Weight, g/mol:

239.132157

ΔHf, kcal/mol:

-14.46

Dipole, Da:

3.04

IP(EA), eV:

-8.95(-0.94)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

4-[(3-fluoro-4-methoxyphenyl)methyl]-2-methylmorpholine

Drug info:

PubChemData

Smile

CC(C(=O)N1CCNC1=O)SC2=NC(=NC3=CC=CC=C32)C4CC4

DOS

IR

Vibrations