Geometry & MOs

Info

ID:	26275
PubChem CID:	643380
Reduced:	NO2C9H13 (1)
Stoich.:	AB2C9D13 (1)
Weight, g/mol:	116.065972
ΔH_f, kcal/mol:	-63.87
Dipole, Da:	3.65
IP(EA), eV:	-8.05(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-ethylthiolane

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1OC)OC)N

DOS

IR

Vibrations