Geometry & MOs

Info

ID:	46292
PubChem CID:	10523755
Reduced:	NS2O6H13C16 (1)
Stoich.:	AB2C6D13E16 (1)
Weight, g/mol:	379.189592
ΔH_f, kcal/mol:	-188.25
Dipole, Da:	3.38
IP(EA), eV:	-9.34(-1.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(2-amino-4-methoxybenzoyl)piperidin-4-yl]-3,4-dihydroquinolin-2-one

Drug info:

PubChemData

Smile

COC(=O)C1=C(S[C@H]2[C@@H](S1)C(=O)N(C2=O)C3=CC=CC=C3)C(=O)OC

DOS

IR

Vibrations