Geometry & MOs

Info

ID:	238773
PubChem CID:	93165474
Reduced:	ON2C19H32 (1)
Stoich.:	AB2C19D32 (1)
Weight, g/mol:	304.251464
ΔH_f, kcal/mol:	-57.77
Dipole, Da:	4.14
IP(EA), eV:	-8.63(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-[(3S)-3-methylpiperidin-1-yl]-2-(3-pentoxyphenyl)ethanamine

Drug info:

PubChemData

Smile

CCCCOC1=CC=CC(=C1)[C@H](CN)N2C[C@H](C[C@@H](C2)C)C

DOS

IR

Vibrations