Geometry & MOs

Info

ID:	262105
PubChem CID:	103270713
Reduced:	NO2C18H23 (1)
Stoich.:	AB2C18D23 (1)
Weight, g/mol:	233.177964
ΔH_f, kcal/mol:	-58.67
Dipole, Da:	2.79
IP(EA), eV:	-8.35(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[(2,6-dimethylphenyl)methylamino]methyl]cyclopentan-1-ol

Drug info:

PubChemData

Smile

COC1=C(C2=CC=CC=C2C=C1)CNCC3CCC(C3)O

DOS

IR

Vibrations