Geometry & MOs

Info

ID:	153314
PubChem CID:	56312496
Reduced:	ClSN2O3C17H25 (1)
Stoich.:	ABC2D3E17F25 (1)
Weight, g/mol:	364.195092
ΔH_f, kcal/mol:	-139.59
Dipole, Da:	4.91
IP(EA), eV:	-9.82(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,4-dimethylquinolin-3-yl)-N-[2-(2-fluorophenyl)-2-methylpropyl]acetamide

Drug info:

PubChemData

Smile

CC1CCC(CC1)(C)NC(=O)CN(C)S(=O)(=O)C2=CC=C(C=C2)Cl

DOS

IR

Vibrations