Geometry & MOs

Info

ID:	201923
PubChem CID:	79605220
Reduced:	N2O3C12H14 (1)
Stoich.:	A2B3C12D14 (1)
Weight, g/mol:	262.240899
ΔH_f, kcal/mol:	-47.12
Dipole, Da:	1.09
IP(EA), eV:	-9.2(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-ethyl-2,5-dimethylpyrrol-3-yl)methyl]cyclooctanamine

Drug info:

PubChemData

Smile

CC(C1=NOC(=N1)CC2=CC=C(C=C2)O)OC

DOS

IR

Vibrations