Geometry & MOs

Info

ID:	432105
PubChem CID:	135172237
Reduced:	NOC11H17 (2)
Stoich.:	ABC11D17 (2)
Weight, g/mol:	178.058299
ΔH_f, kcal/mol:	-88.49
Dipole, Da:	3.72
IP(EA), eV:	-8.14(0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-2,2,3,3-tetramethylthiolane

Drug info:

PubChemData

Smile

CCOC(=O)[C@H]1C[C@H]1C2=CC(=C(C=C2)N(CC(C)C)C3CCCCC3)N

DOS

IR

Vibrations