Geometry & MOs

Info

ID:	404636
PubChem CID:	135068178
Reduced:	SiO3C25H38 (1)
Stoich.:	AB3C25D38 (1)
Weight, g/mol:	398.179442
ΔH_f, kcal/mol:	-183.93
Dipole, Da:	1.85
IP(EA), eV:	-8.71(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-fluoro-2-(4-methylphenyl)propyl]-N-quinolin-8-ylbenzamide

Drug info:

PubChemData

Smile

CC1=CC(=C2[C@H](O[Si](OC2=C1)(C(C)(C)C)C(C)(C)C)CC(=C)C)C#CC(C)(C)O

DOS

IR

Vibrations