Geometry & MOs

Info

ID:	202679
PubChem CID:	79709613
Reduced:	BrFNC13H19 (1)
Stoich.:	ABCD13E19 (1)
Weight, g/mol:	301.08414
ΔH_f, kcal/mol:	-52.26
Dipole, Da:	4.25
IP(EA), eV:	-9.01(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-bromo-5-fluorophenyl)-N-ethyl-3,3-dimethylbutan-2-amine

Drug info:

PubChemData

Smile

CC(C)(C)C(CC1=CC(=CC(=C1)Br)F)NC

DOS

IR

Vibrations