Geometry & MOs

Info

ID:	185872
PubChem CID:	77364123
Reduced:	SN3O6C18H25 (1)
Stoich.:	AB3C6D18E25 (1)
Weight, g/mol:	430.1021
ΔH_f, kcal/mol:	-206.45
Dipole, Da:	4.24
IP(EA), eV:	-8.74(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[1-[5-(2-carboxy-3-thiophen-2-ylprop-1-enyl)-1H-imidazol-2-yl]-2-methylbutyl]thiophene-2-carboxylic acid

Drug info:

PubChemData

Smile

CC(C1C2CC(=C(N2C1=O)OC(=O)O)SC3CC(NC3)C4CC4C(=O)NC)O

DOS

IR

Vibrations