Geometry & MOs

Info

ID:	378965
PubChem CID:	134228574
Reduced:	NC13H25 (1)
Stoich.:	AB13C25 (1)
Weight, g/mol:	289.165349
ΔH_f, kcal/mol:	-29.19
Dipole, Da:	1.89
IP(EA), eV:	-8.59(2.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-tert-butyl-2-(trifluoromethyl)anilino]butan-2-ol

Drug info:

PubChemData

Smile

CC[C@H]1CN(C1C2CCCC2CC)C

DOS

IR

Vibrations