Geometry & MOs

Info

ID:	420800
PubChem CID:	135114828
Reduced:	O2N3C20H25 (1)
Stoich.:	A2B3C20D25 (1)
Weight, g/mol:	327.194677
ΔH_f, kcal/mol:	-58.79
Dipole, Da:	5.54
IP(EA), eV:	-8.83(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[(4R,5R)-4-hydroxy-7-azaspiro[4.5]decan-7-yl]methyl]-9-methylpyrido[1,2-a]pyrimidin-4-one

Drug info:

PubChemData

Smile

C1CNCCC1C(=O)N2C[C@H]([C@@H](C2)O)CC3=NC4=CC=CC=C4C=C3

DOS

IR

Vibrations