Geometry & MOs

Info

ID:	202232
PubChem CID:	79644346
Reduced:	N2O2C17H22 (1)
Stoich.:	A2B2C17D22 (1)
Weight, g/mol:	299.1333
ΔH_f, kcal/mol:	-45.79
Dipole, Da:	3.35
IP(EA), eV:	-8.3(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3,5-difluorophenoxy)-1-(propan-2-ylamino)cyclopentane-1-carboxylic acid

Drug info:

PubChemData

Smile

CC1(CC2=C(O1)C(=CC=C2)OC3CCC(C3)(C#N)NC)C

DOS

IR

Vibrations