Geometry & MOs

Info

ID:	290804
PubChem CID:	111123349
Reduced:	O2N3C19H23 (1)
Stoich.:	A2B3C19D23 (1)
Weight, g/mol:	336.241293
ΔH_f, kcal/mol:	-13.36
Dipole, Da:	3.13
IP(EA), eV:	-8.58(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[2-hydroxy-1-(4-methoxyphenyl)ethyl]-methylamino]-3-(4-methylpiperidin-1-yl)propan-2-ol

Drug info:

PubChemData

Smile

CC1=CN2C=C(N=C2C=C1)CN(C)C(CO)C3=CC=C(C=C3)OC

DOS

IR

Vibrations