Geometry & MOs

Info

ID:	234063
PubChem CID:	92297641
Reduced:	NO3H13C16 (1)
Stoich.:	AB3C13D16 (1)
Weight, g/mol:	278.151809
ΔH_f, kcal/mol:	-29.2
Dipole, Da:	5.84
IP(EA), eV:	-9.33(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-[4-(cyclohexylmethoxy)phenoxy]propanoic acid

Drug info:

PubChemData

Smile

C[C@H](C(=O)O)ON=C1C2=CC=CC=C2C3=CC=CC=C31

DOS

IR

Vibrations