Geometry & MOs

Info

ID:	314018
PubChem CID:	126619600
Reduced:	NO2C17H28 (2)
Stoich.:	AB2C17D28 (2)
Weight, g/mol:	277.240565
ΔH_f, kcal/mol:	-201.04
Dipole, Da:	1.85
IP(EA), eV:	-8.55(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-methyl-3-[3-(2-propylpentoxy)phenyl]propan-1-amine

Drug info:

PubChemData

Smile

CCCC(CCC)COC1=CC(=C(C=C1)O[C@@H](C2=CC(=CC=C2)OCC(CC)CC)[C@H](C)CN)[C@@H]([C@H](C)CN)O

DOS

IR

Vibrations