Geometry & MOs

Info

ID:	254365
PubChem CID:	103124702
Reduced:	ON2C16H20 (1)
Stoich.:	AB2C16D20 (1)
Weight, g/mol:	210.136828
ΔH_f, kcal/mol:	-2.84
Dipole, Da:	1.98
IP(EA), eV:	-9.2(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[2-(hydroxymethyl)cyclohexyl]methyl]-1H-imidazol-2-one

Drug info:

PubChemData

Smile

CCC1CCC(CC1)C(=O)C2=C3C=CC=CN3N=C2

DOS

IR

Vibrations