Geometry & MOs

Info

ID:	371688
PubChem CID:	131270502
Reduced:	BrClNOC7H7 (1)
Stoich.:	ABCDE7F7 (1)
Weight, g/mol:	238.041213
ΔH_f, kcal/mol:	-22.93
Dipole, Da:	3.57
IP(EA), eV:	-8.51(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(methoxymethyl)-2-thiophen-3-yl-1H-imidazole-4-carboxylic acid

Drug info:

PubChemData

Smile

COC1=C(C(=CC(=C1)Br)Cl)N

DOS

IR

Vibrations