Geometry & MOs

Info

ID:	374844
PubChem CID:	131349508
Reduced:	N2O3C10H12 (1)
Stoich.:	A2B3C10D12 (1)
Weight, g/mol:	201.090212
ΔH_f, kcal/mol:	-85.9
Dipole, Da:	1.27
IP(EA), eV:	-8.62(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-(pyridin-3-ylmethyl)imidazol-4-yl]ethanone

Drug info:

PubChemData

Smile

COC(=O)C1=CN(C(=O)C(=C1)N)C2CC2

DOS

IR

Vibrations