Geometry & MOs

Info

ID:	26754
PubChem CID:	798219
Reduced:	SN2O4C17H20 (1)
Stoich.:	AB2C4D17E20 (1)
Weight, g/mol:	305.152812
ΔH_f, kcal/mol:	-112.78
Dipole, Da:	5.53
IP(EA), eV:	-8.64(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[(2,6-dimethylquinolin-4-yl)amino]phenyl]acetamide

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NN=CC2=C(C=C(C=C2)O)O

DOS

IR

Vibrations