Geometry & MOs

Info

ID:	206454
PubChem CID:	80253499
Reduced:	NOC17H23 (1)
Stoich.:	ABC17D23 (1)
Weight, g/mol:	259.154784
ΔH_f, kcal/mol:	-17.77
Dipole, Da:	1.94
IP(EA), eV:	-8.88(0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,3,3-trifluoro-N-[[4-(2-methylpropyl)phenyl]methyl]propan-1-amine

Drug info:

PubChemData

Smile

CC1=CC=C(O1)CNCC2=CC=C(C=C2)CC(C)C

DOS

IR

Vibrations