Geometry & MOs

Info

ID:

239159

PubChem CID:

93166070

Reduced:

NO4C17H29 (1)

Stoich.:

AB4C17D29 (1)

Weight, g/mol:

293.199094

ΔHf, kcal/mol:

-153.86

Dipole, Da:

3.7

IP(EA), eV:

-8.59(0.29)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(2R)-1-[(2,3-dimethoxyphenyl)methyl-propylamino]-2-methylbut-3-en-2-ol

Drug info:

PubChemData

Smile

C[C@H]([C@H](C)O)N(CCCOC)CC1=C(C(=CC=C1)OC)OC

DOS

IR

Vibrations