Geometry & MOs

Info

ID:	209395
PubChem CID:	80665216
Reduced:	BrN2O2C11H21 (1)
Stoich.:	AB2C2D11E21 (1)
Weight, g/mol:	341.00384
ΔH_f, kcal/mol:	-96.31
Dipole, Da:	3.23
IP(EA), eV:	-9.03(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-bromopropyl)-2-fluoro-N-methyl-3-(trifluoromethyl)benzamide

Drug info:

PubChemData

Smile

CCOCC(=O)N1CCCN(CC1)CCBr

DOS

IR

Vibrations