Geometry & MOs

Info

ID:

283123

PubChem CID:

103959252

Reduced:

NOC17H21 (1)

Stoich.:

ABC17D21 (1)

Weight, g/mol:

287.152144

ΔHf, kcal/mol:

-15.83

Dipole, Da:

3.03

IP(EA), eV:

-8.68(-0.08)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(1S)-1-[2-(3,5-dimethoxyphenoxy)phenyl]propan-1-amine

Drug info:

PubChemData

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CC[C@@H](C1=CC=CC=C1OC2=CC(=C(C=C2)C)C)N

DOS

IR

Vibrations