Geometry & MOs

Info

ID:	145864
PubChem CID:	53604535
Reduced:	FNO4C17H18 (1)
Stoich.:	ABC4D17E18 (1)
Weight, g/mol:	346.119654
ΔH_f, kcal/mol:	-174.21
Dipole, Da:	6.84
IP(EA), eV:	-8.76(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(6-chloroquinoline-8-carbonyl)-N-ethylpiperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CO1)C(=O)NC2=C(C=CC(=C2)F)OCC3CCCO3

DOS

IR

Vibrations