Geometry & MOs

Info

ID:	201467
PubChem CID:	79541356
Reduced:	F2N2C13H18 (1)
Stoich.:	A2B2C13D18 (1)
Weight, g/mol:	350.06055
ΔH_f, kcal/mol:	-90.34
Dipole, Da:	1.53
IP(EA), eV:	-8.68(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-N-(1-pyrrolidin-2-ylpropan-2-yl)-2-(trifluoromethyl)aniline

Drug info:

PubChemData

Smile

CC(CC1CCCN1)NC2=C(C=CC(=C2)F)F

DOS

IR

Vibrations