Geometry & MOs

Info

ID:	292857
PubChem CID:	117361135
Reduced:	ClNO3C11H14 (1)
Stoich.:	ABC3D11E14 (1)
Weight, g/mol:	243.08262
ΔH_f, kcal/mol:	-111.84
Dipole, Da:	5.09
IP(EA), eV:	-8.53(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(3-chloro-4-fluoro-2-methoxyphenyl)cyclobutyl]methanamine

Drug info:

PubChemData

Smile

C1COC2=C(O1)C=C(C(=C2CCCN)Cl)O

DOS

IR

Vibrations