Geometry & MOs

Info

ID:	212150
PubChem CID:	81059627
Reduced:	NO2F4C13H15 (1)
Stoich.:	AB2C4D13E15 (1)
Weight, g/mol:	332.08995
ΔH_f, kcal/mol:	-270.94
Dipole, Da:	4.18
IP(EA), eV:	-9.52(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-bromo-4-fluorophenyl)-N-methyl-N-(2-propan-2-yloxyethyl)ethane-1,2-diamine

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations