Geometry & MOs

Info

ID:	128598
PubChem CID:	51051576
Reduced:	SiO4C25H32 (1)
Stoich.:	AB4C25D32 (1)
Weight, g/mol:	413.120941
ΔH_f, kcal/mol:	-150.58
Dipole, Da:	1.83
IP(EA), eV:	-9.05(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-(5-fluoro-2-methylphenyl)-1-quinolin-8-ylsulfonylpyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

C[C@H](C[C@H]1[C@@H](O1)/C=C/C(=O)OC)O[Si](C2=CC=CC=C2)(C3=CC=CC=C3)C(C)(C)C

DOS

IR

Vibrations