Geometry & MOs

Info

ID:	276465
PubChem CID:	103823506
Reduced:	FN2C13H15 (1)
Stoich.:	AB2C13D15 (1)
Weight, g/mol:	318.081382
ΔH_f, kcal/mol:	16.02
Dipole, Da:	4.35
IP(EA), eV:	-9.29(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[3-fluoro-5-(trifluoromethyl)phenyl]methyl]-2-(1,3-thiazol-2-yl)propan-2-amine

Drug info:

PubChemData

Smile

CCC1CC1NCC2=C(C=C(C=C2)C#N)F

DOS

IR

Vibrations