Geometry & MOs

Info

ID:	447603
PubChem CID:	135284181
Reduced:	F2S2N3O3H9C10 (1)
Stoich.:	A2B2C3D3E9F10 (1)
Weight, g/mol:	270.107836
ΔH_f, kcal/mol:	-149.66
Dipole, Da:	8.1
IP(EA), eV:	-9.17(-1.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-benzylsulfanyl-1,2,3,4-tetrahydronaphthalen-1-ol

Drug info:

PubChemData

Smile

CC(C1=CC(=C(C=C1F)S(=O)(=O)NC2=NC=NS2)F)O

DOS

IR

Vibrations