Geometry & MOs

Info

ID:	396396
PubChem CID:	135028252
Reduced:	O5C18H22 (1)
Stoich.:	A5B18C22 (1)
Weight, g/mol:	332.162374
ΔH_f, kcal/mol:	-197.78
Dipole, Da:	1.63
IP(EA), eV:	-9.47(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl (2R)-2-phenyl-1-oxaspiro[4.5]decane-4,4-dicarboxylate

Drug info:

PubChemData

Smile

COC(=O)C1(C[C@@H](OC12CCCC2)C3=CC=CC=C3)C(=O)OC

DOS

IR

Vibrations