Geometry & MOs

Info

ID:	134447
PubChem CID:	51698364
Reduced:	N2O2C17H26 (1)
Stoich.:	A2B2C17D26 (1)
Weight, g/mol:	146.040151
ΔH_f, kcal/mol:	-97.42
Dipole, Da:	2.34
IP(EA), eV:	-8.98(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R)-2,2,4-trimethyl-1,3-oxathiolan-5-one

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CCC[C@H](C1)NCC2=CC=CC=C2

DOS

IR

Vibrations