Geometry & MOs

Info

ID:	203638
PubChem CID:	79853288
Reduced:	ClON2C15H25 (1)
Stoich.:	ABC2D15E25 (1)
Weight, g/mol:	212.141244
ΔH_f, kcal/mol:	-66.45
Dipole, Da:	3.56
IP(EA), eV:	-9.01(0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 4,4-dimethyl-1-oxaspiro[2.5]octane-2-carboxylate

Drug info:

PubChemData

Smile

CCC1=NN(C(=C1Cl)CC2(CCCCC2(C)C)O)C

DOS

IR

Vibrations