Geometry & MOs

Info

ID:	305689
PubChem CID:	124965625
Reduced:	SF2N4O4C19H22 (1)
Stoich.:	AB2C4D4E19F22 (1)
Weight, g/mol:	356.184841
ΔH_f, kcal/mol:	-193.55
Dipole, Da:	1.15
IP(EA), eV:	-9.38(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(2R)-2-(1,4-dimethylimidazol-2-yl)morpholine-4-carbonyl]-5,6,7,8-tetrahydro-1H-quinolin-2-one

Drug info:

PubChemData

Smile

C1C[C@H](CN(C1)S(=O)(=O)C2=CC(=C(C=C2)F)F)C3=C(C=NN3)C(=O)N4CCOCC4

DOS

IR

Vibrations