Geometry & MOs

Info

ID:	446576
PubChem CID:	135276148
Reduced:	NO2S3C12H15 (1)
Stoich.:	AB2C3D12E15 (1)
Weight, g/mol:	285.049336
ΔH_f, kcal/mol:	-11.91
Dipole, Da:	6.13
IP(EA), eV:	-8.4(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[2-(2-hydroxyethylsulfanyl)ethylamino]-3-methylfuro[3,2-b]pyran-7-thione

Drug info:

PubChemData

Smile

CC1=COC2=C1OC(=CC2=S)N(CCS)CCS

DOS

IR

Vibrations