Geometry & MOs

Info

ID:	279831
PubChem CID:	103845287
Reduced:	NO2C14H19 (1)
Stoich.:	AB2C14D19 (1)
Weight, g/mol:	339.08339
ΔH_f, kcal/mol:	-71.64
Dipole, Da:	3.13
IP(EA), eV:	-8.75(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-bromo-4,5-dimethoxyphenyl)methyl]-2-(cyclopenten-1-yl)ethanamine

Drug info:

PubChemData

Smile

C1CC=C(C1)CCNCC2=C(C=C(C=C2)O)O

DOS

IR

Vibrations