Geometry & MOs

Info

ID:	276446
PubChem CID:	103823321
Reduced:	ClSN3O3C11H16 (1)
Stoich.:	ABC3D3E11F16 (1)
Weight, g/mol:	257.152812
ΔH_f, kcal/mol:	-118.08
Dipole, Da:	6.27
IP(EA), eV:	-9.03(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,2,2-trimethyl-3-(quinolin-4-ylamino)propanamide

Drug info:

PubChemData

Smile

CC(C)(CNC1=NC(=C(S1)C(=O)OC)Cl)C(=O)NC

DOS

IR

Vibrations