Geometry & MOs

Info

ID:	198635
PubChem CID:	79128061
Reduced:	N2O3C15H24 (1)
Stoich.:	A2B3C15D24 (1)
Weight, g/mol:	211.120843
ΔH_f, kcal/mol:	-132.26
Dipole, Da:	4.69
IP(EA), eV:	-9.98(0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-(1-cyano-3-ethylcyclopentyl)-2-hydroxyacetate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CC(C1)(C2(CCCCC2)C#N)O

DOS

IR

Vibrations