Geometry & MOs

Info

ID:	254349
PubChem CID:	103124527
Reduced:	N2O3C9H12 (1)
Stoich.:	A2B3C9D12 (1)
Weight, g/mol:	198.100442
ΔH_f, kcal/mol:	-102.23
Dipole, Da:	6.26
IP(EA), eV:	-9.22(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-5-(2-oxo-1H-imidazol-3-yl)pentanoic acid

Drug info:

PubChemData

Smile

C1CC1C(CC(=O)O)N2C=CNC2=O

DOS

IR

Vibrations