Geometry & MOs

Info

ID:	31314
PubChem CID:	855564
Reduced:	N3O3H13C14 (1)
Stoich.:	A3B3C13D14 (1)
Weight, g/mol:	346.135114
ΔH_f, kcal/mol:	-44.11
Dipole, Da:	4.49
IP(EA), eV:	-8.99(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-ethyl-7-methoxyquinolin-2-yl)sulfanyl-1-morpholin-4-ylethanone

Drug info:

PubChemData

Smile

CC1=CN=C(C=N1)C(=O)NCC2=CC3=C(C=C2)OCO3

DOS

IR

Vibrations