Geometry & MOs

Info

ID:	248463
PubChem CID:	103081857
Reduced:	NO2C13H19 (1)
Stoich.:	AB2C13D19 (1)
Weight, g/mol:	280.142307
ΔH_f, kcal/mol:	-76.18
Dipole, Da:	2.28
IP(EA), eV:	-8.95(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methoxy-N-[(4-methoxy-3-nitrophenyl)methyl]cyclopentan-1-amine

Drug info:

PubChemData

Smile

COC1CCC(C1)NCC2=CC=CC=C2O

DOS

IR

Vibrations