Geometry & MOs

Info

ID:	304556
PubChem CID:	124756280
Reduced:	ON6C14H22 (1)
Stoich.:	AB6C14D22 (1)
Weight, g/mol:	380.109625
ΔH_f, kcal/mol:	42.03
Dipole, Da:	5.89
IP(EA), eV:	-9.54(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-6,7,8-trifluoro-N-[(1R)-1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]-4-oxoquinoline-3-carboxamide

Drug info:

PubChemData

Smile

CC1=NOC(=N1)[C@@H]2CCCCN2CC3=NN=CN3C(C)C

DOS

IR

Vibrations