Geometry & MOs

Info

ID:	395445
PubChem CID:	135025496
Reduced:	O5C30H36 (1)
Stoich.:	A5B30C36 (1)
Weight, g/mol:	292.131074
ΔH_f, kcal/mol:	-113.93
Dipole, Da:	4.78
IP(EA), eV:	-8.64(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

diethyl (4R)-4-methyl-4-phenyloxetane-2,2-dicarboxylate

Drug info:

PubChemData

Smile

CC1([C@@H]2[C@H](C[C@]3(C1C[C@H](C=C([C@H]3OCC4=CC=C(C=C4)OC)C=C)O)O2)OCC5=CC=CC=C5)C

DOS

IR

Vibrations