Geometry & MOs

Info

ID:	254370
PubChem CID:	103124735
Reduced:	N2O2C15H18 (1)
Stoich.:	A2B2C15D18 (1)
Weight, g/mol:	210.136828
ΔH_f, kcal/mol:	-35.89
Dipole, Da:	2.71
IP(EA), eV:	-9.22(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CC(OC1)CCCC(=O)C2=C3C=CC=CN3N=C2

DOS

IR

Vibrations