Geometry & MOs

Info

ID:	25234
PubChem CID:	621129
Reduced:	NSeH9C13 (1)
Stoich.:	ABC9D13 (1)
Weight, g/mol:	301.142641
ΔH_f, kcal/mol:	86.44
Dipole, Da:	2.9
IP(EA), eV:	-8.57(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-acetyl-3-(1-acetylpiperidin-4-yl)benzimidazol-2-one

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=N[Se]C3=CC=CC=C32

DOS

IR

Vibrations