Geometry & MOs

Info

ID:	254363
PubChem CID:	103124691
Reduced:	ON5C14H15 (1)
Stoich.:	AB5C14D15 (1)
Weight, g/mol:	184.121178
ΔH_f, kcal/mol:	68.91
Dipole, Da:	2.37
IP(EA), eV:	-9.19(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-ethyl-2-hydroxybutyl)-1H-imidazol-2-one

Drug info:

PubChemData

Smile

CC(C)N1C=CC(=N1)CC(=O)C2=C3C=NC=CN3N=C2

DOS

IR

Vibrations