Geometry & MOs

Info

ID:	242151
PubChem CID:	96079320
Reduced:	FNOH12C15 (1)
Stoich.:	ABCD12E15 (1)
Weight, g/mol:	249.09652
ΔH_f, kcal/mol:	-22.05
Dipole, Da:	6.05
IP(EA), eV:	-9.78(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(R)-(2-fluoro-3-methoxyphenyl)-(2-fluorophenyl)methanamine

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C#N)[C@H](C2=CC=C(C=C2)F)O

DOS

IR

Vibrations