Geometry & MOs

Info

ID:	360662
PubChem CID:	127301307
Reduced:	O2N5C14H21 (1)
Stoich.:	A2B5C14D21 (1)
Weight, g/mol:	349.153875
ΔH_f, kcal/mol:	-46.55
Dipole, Da:	6.42
IP(EA), eV:	-9.47(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CC1NC(=O)NC(=O)CN2CCC(CC2)N3C=CN=C3

DOS

IR

Vibrations