Geometry & MOs

Info

ID:	358027
PubChem CID:	127295563
Reduced:	O2N4C19H26 (1)
Stoich.:	A2B4C19D26 (1)
Weight, g/mol:	352.189926
ΔH_f, kcal/mol:	-14.71
Dipole, Da:	5.27
IP(EA), eV:	-8.76(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-piperidin-1-ylpyrrolidin-1-yl)methyl]-1H-[1]benzofuro[3,2-d]pyrimidin-4-one

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C2=NN=C(O2)CN3CCC(C3)N4CCCCC4

DOS

IR

Vibrations