Geometry & MOs

Info

ID:	238187
PubChem CID:	92729772
Reduced:	FON3C23H24 (1)
Stoich.:	ABC3D23E24 (1)
Weight, g/mol:	377.190341
ΔH_f, kcal/mol:	-32.43
Dipole, Da:	5.69
IP(EA), eV:	-8.06(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-(8-fluoro-2-pyrrolidin-1-ylquinolin-6-yl)-2-phenylbutanamide

Drug info:

PubChemData

Smile

CC[C@H](C1=CC=CC=C1)C(=O)NC2=CC(=C3C(=C2)C=CC(=N3)N4CCCC4)F

DOS

IR

Vibrations