Geometry & MOs

Info

ID:	425183
PubChem CID:	135125454
Reduced:	NC5H8 (2)
Stoich.:	AB5C8 (2)
Weight, g/mol:	238.106122
ΔH_f, kcal/mol:	0.43
Dipole, Da:	3.15
IP(EA), eV:	-9.49(1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,6-bis(sulfanyl)decane-1,10-diol

Drug info:

PubChemData

Smile

C1CC2(CCC1(CC2)CC#N)N

DOS

IR

Vibrations