Geometry & MOs

Info

ID:	183231
PubChem CID:	76995453
Reduced:	N2O2C15H18 (1)
Stoich.:	A2B2C15D18 (1)
Weight, g/mol:	259.132077
ΔH_f, kcal/mol:	-17.09
Dipole, Da:	8.54
IP(EA), eV:	-9.14(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[C-methyl-N-(oxan-3-yl)carbonimidoyl]-1,3-dihydrobenzimidazol-2-one

Drug info:

PubChemData

Smile

C1CC(COC1)NCC2=CC3C=CC=CC3=NC2=O

DOS

IR

Vibrations