Geometry & MOs

Info

ID:	293523
PubChem CID:	117392386
Reduced:	ClNO2C13H18 (1)
Stoich.:	ABC2D13E18 (1)
Weight, g/mol:	255.102607
ΔH_f, kcal/mol:	-88.41
Dipole, Da:	0.6
IP(EA), eV:	-8.67(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[1-(aminomethyl)cyclopentyl]-4-chloro-2-methoxyphenol

Drug info:

PubChemData

Smile

CC(CC1=C(C=CC(=C1)Cl)N2CCOCC2)O

DOS

IR

Vibrations