Geometry & MOs

Info

ID:	319853
PubChem CID:	126657407
Reduced:	NO2C11H23 (1)
Stoich.:	AB2C11D23 (1)
Weight, g/mol:	384.159769
ΔH_f, kcal/mol:	-106.51
Dipole, Da:	3.05
IP(EA), eV:	-8.43(2.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-fluoro-2-[4-methoxy-3-(piperazin-1-ylmethoxy)phenyl]pyrido[1,2-a]pyrimidin-4-one

Drug info:

PubChemData

Smile

C[C@H]1COCCN1C[C@H](C)CCOC

DOS

IR

Vibrations