Geometry & MOs

Info

ID:	281028
PubChem CID:	103852456
Reduced:	BrClNC11H15 (1)
Stoich.:	ABCD11E15 (1)
Weight, g/mol:	263.129712
ΔH_f, kcal/mol:	-7.41
Dipole, Da:	0.99
IP(EA), eV:	-9.53(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-fluoro-3-(trifluoromethyl)phenyl]-3,3-dimethylbutan-1-amine

Drug info:

PubChemData

Smile

CC(C)(C)C(C1=C(C=CC(=C1)Cl)Br)N

DOS

IR

Vibrations