Geometry & MOs

Info

ID:	236493
PubChem CID:	92713457
Reduced:	FN3O3C24H28 (1)
Stoich.:	AB3C3D24E28 (1)
Weight, g/mol:	425.137556
ΔH_f, kcal/mol:	-118.84
Dipole, Da:	2.28
IP(EA), eV:	-8.58(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl 2-(5-methylfuran-2-yl)quinoline-4-carboxylate

Drug info:

PubChemData

Smile

CCN1CCN(CC1)[C@@H](C2=CC(=CC=C2)F)C3=C(C=C(N(C3=O)CC4=CC=CO4)C)O

DOS

IR

Vibrations