Geometry & MOs

Info

ID:	375807
PubChem CID:	134221797
Reduced:	NO2C11H19 (1)
Stoich.:	AB2C11D19 (1)
Weight, g/mol:	303.92775
ΔH_f, kcal/mol:	-100.14
Dipole, Da:	2.56
IP(EA), eV:	-8.89(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(1-bromo-2,2,2-trifluoroethyl)-1-chloro-2-fluoro-3-methylbenzene

Drug info:

PubChemData

Smile

CCC/C=C(/C(=C(\C)/CC)/O)\C(=O)N

DOS

IR

Vibrations