Geometry & MOs

Info

ID:	292858
PubChem CID:	117361352
Reduced:	ClFNOC12H15 (1)
Stoich.:	ABCDE12F15 (1)
Weight, g/mol:	243.08262
ΔH_f, kcal/mol:	-70.0
Dipole, Da:	2.34
IP(EA), eV:	-9.17(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-chloro-2-fluoro-6-methoxy-5-methylphenyl)cyclobutan-1-amine

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1Cl)F)C2(CCC2)CN

DOS

IR

Vibrations