Geometry & MOs

Info

ID:	246082
PubChem CID:	103043327
Reduced:	ClFNO2C12H15 (1)
Stoich.:	ABCD2E12F15 (1)
Weight, g/mol:	299.068862
ΔH_f, kcal/mol:	-124.67
Dipole, Da:	2.47
IP(EA), eV:	-9.48(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-chloro-4-fluorophenyl)-1-(2,6-difluoro-3-methylphenyl)ethanamine

Drug info:

PubChemData

Smile

C1COC(CO1)C(CC2=CC(=C(C=C2)F)Cl)N

DOS

IR

Vibrations