Geometry & MOs

Info

ID:	418864
PubChem CID:	135106975
Reduced:	OSN3C16H21 (1)
Stoich.:	ABC3D16E21 (1)
Weight, g/mol:	376.164774
ΔH_f, kcal/mol:	7.74
Dipole, Da:	5.22
IP(EA), eV:	-8.83(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[1-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-yl]-1H-benzimidazol-2-one

Drug info:

PubChemData

Smile

CN1C=CN=C1CN2CCC3(CC2)C4=C(CCO3)SC=C4

DOS

IR

Vibrations