Geometry & MOs

Info

ID:	387696
PubChem CID:	134986459
Reduced:	SC5H7 (2)
Stoich.:	AB5C7 (2)
Weight, g/mol:	299.137757
ΔH_f, kcal/mol:	16.16
Dipole, Da:	2.43
IP(EA), eV:	-8.65(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,2S)-1-tert-butylsulfanyl-3,3-dimethyl-1-pyridin-2-ylsulfanylbutan-2-ol

Drug info:

PubChemData

Smile

CC(SC)SCC1=CC=CC=C1

DOS

IR

Vibrations