Geometry & MOs

Info

ID:	434627
PubChem CID:	135175368
Reduced:	SF2N3O5C33H45 (1)
Stoich.:	AB2C3D5E33F45 (1)
Weight, g/mol:	286.120509
ΔH_f, kcal/mol:	-302.46
Dipole, Da:	8.25
IP(EA), eV:	-9.15(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(6-cyclopentyloxynaphthalen-2-yl)-2-hydroxyacetic acid

Drug info:

PubChemData

Smile

C1CCC(CC1)COC2=CC=C(C=C2)S(=O)(=O)N[C@@H](C(=O)N3CCC(CC3)N)C(C4=CC=C(C=C4)OC5CCCCC5)(F)F

DOS

IR

Vibrations