Geometry & MOs

Info

ID:	31378
PubChem CID:	855638
Reduced:	N2O5C17H22 (1)
Stoich.:	A2B5C17D22 (1)
Weight, g/mol:	342.119127
ΔH_f, kcal/mol:	-190.17
Dipole, Da:	5.87
IP(EA), eV:	-8.65(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-2,2,2-trifluoro-N-(2-hydroxyethyl)acetamide

Drug info:

PubChemData

Smile

CCC(=O)N(CCO)CC1=CC2=CC(=C(C=C2NC1=O)OC)OC

DOS

IR

Vibrations