Geometry & MOs

Info

ID:	204499
PubChem CID:	79973232
Reduced:	NO3S3C12H23 (1)
Stoich.:	AB3C3D12E23 (1)
Weight, g/mol:	246.020679
ΔH_f, kcal/mol:	-158.43
Dipole, Da:	4.55
IP(EA), eV:	-8.6(0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1,4-dithian-2-yl)-2-thiophen-2-ylethanol

Drug info:

PubChemData

Smile

CS(=O)(=O)N1CCCC(C1)CC(C2CSCCS2)O

DOS

IR

Vibrations