Geometry & MOs

Info

ID:	262717
PubChem CID:	103311059
Reduced:	BrNO2F6C11H14 (1)
Stoich.:	ABC2D6E11F14 (1)
Weight, g/mol:	299.051161
ΔH_f, kcal/mol:	-417.79
Dipole, Da:	7.1
IP(EA), eV:	-10.08(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-chloro-3-methylbutan-2-yl)-3,3,3-trifluoro-2-(trifluoromethyl)propanamide

Drug info:

PubChemData

Smile

C1CN(CCC1OCCBr)C(=O)C(C(F)(F)F)C(F)(F)F

DOS

IR

Vibrations