Geometry & MOs

Info

ID:	150816
PubChem CID:	53790512
Reduced:	FN2O3C17H17 (1)
Stoich.:	AB2C3D17E17 (1)
Weight, g/mol:	583.214092
ΔH_f, kcal/mol:	-134.19
Dipole, Da:	7.2
IP(EA), eV:	-8.28(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[[2-butyl-6-[(4-methylphenyl)sulfonylamino]benzimidazol-1-yl]methyl]phenoxy]-2-phenylacetic acid

Drug info:

PubChemData

Smile

C1CCC(=O)C2=C(C1)NC=C2C(=O)NC3=CC=CC=C3OCF

DOS

IR

Vibrations