Geometry & MOs

Info

ID:	270799
PubChem CID:	103638170
Reduced:	SN2O2F3C12H17 (1)
Stoich.:	AB2C2D3E12F17 (1)
Weight, g/mol:	277.128963
ΔH_f, kcal/mol:	-231.61
Dipole, Da:	3.69
IP(EA), eV:	-9.05(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-methoxy-5-methylphenyl)methyl-(2,2,2-trifluoroethyl)amino]ethanol

Drug info:

PubChemData

Smile

C1=CSC(=C1)CCNC(=O)CN(CCO)CC(F)(F)F

DOS

IR

Vibrations