Geometry & MOs

Info

ID:	271700
PubChem CID:	103689341
Reduced:	SN2C9H14 (1)
Stoich.:	AB2C9D14 (1)
Weight, g/mol:	190.09938
ΔH_f, kcal/mol:	16.64
Dipole, Da:	2.38
IP(EA), eV:	-8.46(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3,5-dimethylphenyl)oxolan-2-one

Drug info:

PubChemData

Smile

CCSC1=C(C=CC=N1)[C@H](C)N

DOS

IR

Vibrations