Geometry & MOs

Info

ID:	342533
PubChem CID:	127265688
Reduced:	N3O3C14H17 (1)
Stoich.:	A3B3C14D17 (1)
Weight, g/mol:	274.179361
ΔH_f, kcal/mol:	-53.68
Dipole, Da:	1.79
IP(EA), eV:	-9.32(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[(1,2-dimethylpiperidin-4-yl)amino]methyl]-1,3-dihydrobenzimidazol-2-one

Drug info:

PubChemData

Smile

CCC=CCOC(=O)C1=CN=C2C(=C1OC)C=NN2C

DOS

IR

Vibrations