Geometry & MOs

Info

ID:	284592
PubChem CID:	104054514
Reduced:	NOC18H21 (1)
Stoich.:	ABC18D21 (1)
Weight, g/mol:	261.209264
ΔH_f, kcal/mol:	-17.52
Dipole, Da:	3.02
IP(EA), eV:	-8.15(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-methoxy-2,5-dimethylphenyl)-N-propylcyclopentan-1-amine

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1OC)C)C2=CC3=C(CCCN3)C=C2

DOS

IR

Vibrations