Geometry & MOs

Info

ID:	139619
PubChem CID:	52572003
Reduced:	OCl2F3N3H14C15 (1)
Stoich.:	AB2C3D3E14F15 (1)
Weight, g/mol:	287.113313
ΔH_f, kcal/mol:	-158.8
Dipole, Da:	1.88
IP(EA), eV:	-9.75(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,4-dihydro-2H-quinolin-1-yl)-3-(2,2,2-trifluoroethoxy)propan-1-one

Drug info:

PubChemData

Smile

C[C@@H](C1=C(C=C(C=C1)Cl)Cl)N(C)C(=O)CN2C=CC(=N2)C(F)(F)F

DOS

IR

Vibrations