Geometry & MOs

Info

ID:	287828
PubChem CID:	104295844
Reduced:	OF2N2C16H18 (1)
Stoich.:	AB2C2D16E18 (1)
Weight, g/mol:	295.118399
ΔH_f, kcal/mol:	-75.69
Dipole, Da:	2.86
IP(EA), eV:	-9.06(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-1-(2,4-difluoro-5-methylphenyl)-2-(3-fluorophenyl)propan-1-ol

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1F)F)C2=CN=C(O2)CCCNC3CC3

DOS

IR

Vibrations