Geometry & MOs

Info

ID:	265284
PubChem CID:	103516655
Reduced:	BrNOF2C7H8 (1)
Stoich.:	ABCD2E7F8 (1)
Weight, g/mol:	321.05398
ΔH_f, kcal/mol:	-106.9
Dipole, Da:	2.23
IP(EA), eV:	-9.54(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-bromo-5-methoxyphenyl)-1,1-difluoro-N-propylpropan-2-amine

Drug info:

PubChemData

Smile

CNC(C1=C(C=CO1)Br)C(F)F

DOS

IR

Vibrations