Geometry & MOs

Info

ID:	295005
PubChem CID:	117511399
Reduced:	O3F6H12C13 (1)
Stoich.:	A3B6C12D13 (1)
Weight, g/mol:	329.09904
ΔH_f, kcal/mol:	-439.31
Dipole, Da:	2.68
IP(EA), eV:	-10.36(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-bromo-3,4-dimethoxy-2-propan-2-ylphenyl)-2-methylpropan-2-amine

Drug info:

PubChemData

Smile

CCOC(=O)C(C1=CC=C(C=C1)C(C(F)(F)F)C(F)(F)F)O

DOS

IR

Vibrations