Geometry & MOs

Info

ID:	279838
PubChem CID:	103845303
Reduced:	NOC17H21 (1)
Stoich.:	ABC17D21 (1)
Weight, g/mol:	293.118257
ΔH_f, kcal/mol:	43.63
Dipole, Da:	2.1
IP(EA), eV:	-8.85(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-2-(cyclopenten-1-yl)ethanamine

Drug info:

PubChemData

Smile

C#CCOC1=CC=CC=C1CNCCC2=CCCC2

DOS

IR

Vibrations