Geometry & MOs

Info

ID:	187273
PubChem CID:	77553100
Reduced:	ClON7C19H26 (1)
Stoich.:	ABC7D19E26 (1)
Weight, g/mol:	301.153875
ΔH_f, kcal/mol:	23.48
Dipole, Da:	1.75
IP(EA), eV:	-8.56(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-1-hydroxy-6-[[methyl-(2-methylpyrazol-3-yl)amino]methyl]-3,4-dihydroquinolin-2-one

Drug info:

PubChemData

Smile

CCN1C=C(C=N1)NC2=NC=C(C(=N2)NC3C(CC4CC3C4(C)C)C(=O)N)Cl

DOS

IR

Vibrations