Geometry & MOs

Info

ID:	396395
PubChem CID:	135028251
Reduced:	O5C16H20 (1)
Stoich.:	A5B16C20 (1)
Weight, g/mol:	318.146724
ΔH_f, kcal/mol:	-202.35
Dipole, Da:	3.22
IP(EA), eV:	-9.49(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl (2R)-2-phenyl-1-oxaspiro[4.4]nonane-4,4-dicarboxylate

Drug info:

PubChemData

Smile

CC1(C(C[C@@H](O1)C2=CC=CC=C2)(C(=O)OC)C(=O)OC)C

DOS

IR

Vibrations