Geometry & MOs

Info

ID:	19941
PubChem CID:	575492
Reduced:	SC9H18 (1)
Stoich.:	AB9C18 (1)
Weight, g/mol:	158.112922
ΔH_f, kcal/mol:	-39.69
Dipole, Da:	2.27
IP(EA), eV:	-8.39(1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-3-propylthiane

Drug info:

PubChemData

Smile

CCCC1CCCSC1C

DOS

IR

Vibrations