Geometry & MOs

Info

ID:	250558
PubChem CID:	103097517
Reduced:	ClSO2N3H12C13 (1)
Stoich.:	ABC2D3E12F13 (1)
Weight, g/mol:	221.116427
ΔH_f, kcal/mol:	3.06
Dipole, Da:	4.2
IP(EA), eV:	-8.7(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-ethyl-7-methylimidazo[1,2-a]imidazole-6-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=CN2C=C(N=C2N1C)C3=CC=C(S3)Cl

DOS

IR

Vibrations