Geometry & MOs

Info

ID:	201806
PubChem CID:	79586913
Reduced:	NO3C17H27 (1)
Stoich.:	AB3C17D27 (1)
Weight, g/mol:	297.230394
ΔH_f, kcal/mol:	-122.17
Dipole, Da:	3.7
IP(EA), eV:	-8.44(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-(2-cyclohexyloxyethyl)-1-(methylamino)cyclopentane-1-carboxylate

Drug info:

PubChemData

Smile

CCNC1(CCCC1CCOC2=CC=CC=C2OC)CO

DOS

IR

Vibrations