Geometry & MOs

Info

ID:	259628
PubChem CID:	103169851
Reduced:	NOC13H27 (1)
Stoich.:	ABC13D27 (1)
Weight, g/mol:	299.14522
ΔH_f, kcal/mol:	-77.45
Dipole, Da:	1.56
IP(EA), eV:	-8.81(2.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-chloro-4-fluorophenyl)-3-(3-ethoxycyclobutyl)-N-methylpropan-2-amine

Drug info:

PubChemData

Smile

CC(C)(CCC(CC1CCC1)NC)OC

DOS

IR

Vibrations