Geometry & MOs

Info

ID:	203929
PubChem CID:	79891254
Reduced:	BrNOF2H14C15 (1)
Stoich.:	ABCD2E14F15 (1)
Weight, g/mol:	231.107085
ΔH_f, kcal/mol:	-77.78
Dipole, Da:	2.55
IP(EA), eV:	-9.32(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3,5-difluoro-4-(2-methoxyethoxy)phenyl]-N-methylmethanamine

Drug info:

PubChemData

Smile

CNCC1=CC(=C(C(=C1)F)OCC2=CC=C(C=C2)Br)F

DOS

IR

Vibrations