Geometry & MOs

Info

ID:	277226
PubChem CID:	103827362
Reduced:	ClNC13H18 (1)
Stoich.:	ABC13D18 (1)
Weight, g/mol:	299.084081
ΔH_f, kcal/mol:	11.56
Dipole, Da:	2.75
IP(EA), eV:	-9.18(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-N-(5-ethyl-1,3,4-thiadiazol-2-yl)quinoline-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)C1=CC=C(C=C1)CNC/C=C/Cl

DOS

IR

Vibrations