Geometry & MOs

Info

ID:	392149
PubChem CID:	135013331
Reduced:	O5C10H16 (1)
Stoich.:	A5B10C16 (1)
Weight, g/mol:	141.102788
ΔH_f, kcal/mol:	-245.55
Dipole, Da:	1.52
IP(EA), eV:	-10.12(0.59)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

1-(2,3-dimethyl-4,5-dihydroimidazol-3-ium-1-yl)ethanone

Drug info:

PubChemData

Smile

CC(=O)OCC1CCCC(O1)OC(=O)C

DOS

IR

Vibrations