Geometry & MOs

Info

ID:	258666
PubChem CID:	103156167
Reduced:	O2N3C13H25 (1)
Stoich.:	A2B3C13D25 (1)
Weight, g/mol:	292.167459
ΔH_f, kcal/mol:	-97.86
Dipole, Da:	4.67
IP(EA), eV:	-9.04(1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 4-(3-cyclopentyl-2-hydroxypropoxy)benzoate

Drug info:

PubChemData

Smile

CN1C2CCC1CN(CC2)C(=O)CC(CN)OC

DOS

IR

Vibrations