Geometry & MOs

Info

ID:	258686
PubChem CID:	103156362
Reduced:	NO2C18H29 (1)
Stoich.:	AB2C18D29 (1)
Weight, g/mol:	293.199094
ΔH_f, kcal/mol:	-97.08
Dipole, Da:	2.76
IP(EA), eV:	-8.77(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclopentyl-3-[2-methoxy-4-(methylaminomethyl)phenoxy]propan-2-ol

Drug info:

PubChemData

Smile

CCCNCC1=CC=CC=C1OCC(CC2CCCC2)O

DOS

IR

Vibrations