Geometry & MOs

Info

ID:	294041
PubChem CID:	117424523
Reduced:	NOC8H8 (2)
Stoich.:	ABC8D8 (2)
Weight, g/mol:	268.132411
ΔH_f, kcal/mol:	-42.15
Dipole, Da:	3.05
IP(EA), eV:	-8.82(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(8-ethoxyquinolin-5-yl)-2-methylpyrazol-3-amine

Drug info:

PubChemData

Smile

CC(C)(CC(=O)O)C1=CC2=C(C=C1)NC3=C2C=CC=N3

DOS

IR

Vibrations