Geometry & MOs

Info

ID:	213039
PubChem CID:	81062606
Reduced:	ClON6C11H15 (1)
Stoich.:	ABC6D11E15 (1)
Weight, g/mol:	291.04456
ΔH_f, kcal/mol:	55.52
Dipole, Da:	3.33
IP(EA), eV:	-9.56(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-3,3,3-trifluoro-N-methyl-N-(2-propan-2-yloxyethyl)propan-1-amine

Drug info:

PubChemData

Smile

CCOCCN(C)C1=NC(=NC(=N1)N2C=CC=N2)Cl

DOS

IR

Vibrations