Geometry & MOs

Info

ID:	278831
PubChem CID:	103838787
Reduced:	BrClNOC13H17 (1)
Stoich.:	ABCDE13F17 (1)
Weight, g/mol:	274.124819
ΔH_f, kcal/mol:	-42.34
Dipole, Da:	1.34
IP(EA), eV:	-9.22(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3-chloro-2-fluorophenyl)methylamino]-3-(dimethylamino)-2-methylpropan-2-ol

Drug info:

PubChemData

Smile

CC1(CCOCC1)NCC2=C(C=CC(=C2)Br)Cl

DOS

IR

Vibrations