Geometry & MOs

Info

ID:	146310
PubChem CID:	53668365
Reduced:	OS2N4C6H10 (1)
Stoich.:	AB2C4D6E10 (1)
Weight, g/mol:	507.252192
ΔH_f, kcal/mol:	-0.92
Dipole, Da:	3.85
IP(EA), eV:	-8.72(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[[6-(4,5-diethyl-1,3-oxazol-2-yl)-4-methyl-2-propylbenzimidazol-1-yl]methyl]phenyl]benzoic acid

Drug info:

PubChemData

Smile

CC(NC(=O)C)SC1=NN=C(S1)N

DOS

IR

Vibrations