Geometry & MOs

Info

ID:	265672
PubChem CID:	103537740
Reduced:	NO3C13H27 (1)
Stoich.:	AB3C13D27 (1)
Weight, g/mol:	281.162708
ΔH_f, kcal/mol:	-152.73
Dipole, Da:	4.45
IP(EA), eV:	-9.0(1.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,4-dimethoxypyrrolidin-1-yl)-1-(4-methoxyphenyl)ethanol

Drug info:

PubChemData

Smile

CCCC(C(CC)N1CC(C(C1)OC)OC)O

DOS

IR

Vibrations