Geometry & MOs

Info

ID:	276467
PubChem CID:	103823513
Reduced:	FON2C15H21 (1)
Stoich.:	ABC2D15E21 (1)
Weight, g/mol:	319.065398
ΔH_f, kcal/mol:	-69.1
Dipole, Da:	4.16
IP(EA), eV:	-9.51(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[3-fluoro-5-(trifluoromethyl)phenyl]methylamino]-1-thiophen-3-ylethanol

Drug info:

PubChemData

Smile

CC(C)(C)CC(CNCC1=C(C=C(C=C1)C#N)F)O

DOS

IR

Vibrations