Geometry & MOs

Info

ID:	420172
PubChem CID:	135111650
Reduced:	FN2O5H15C18 (1)
Stoich.:	AB2C5D15E18 (1)
Weight, g/mol:	353.173942
ΔH_f, kcal/mol:	-185.01
Dipole, Da:	7.24
IP(EA), eV:	-9.62(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-oxo-N-[(3R,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C2C=C(C=CC2=N1)F)C(=O)N3C[C@]4(C[C@]4(C3)C(=O)O)C(=O)O

DOS

IR

Vibrations