Geometry & MOs

Info

ID:	229346
PubChem CID:	87567451
Reduced:	NOC8H13 (1)
Stoich.:	ABC8D13 (1)
Weight, g/mol:	276.194543
ΔH_f, kcal/mol:	-36.03
Dipole, Da:	3.41
IP(EA), eV:	-9.16(0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

pentadecane-1,5-dithiol

Drug info:

PubChemData

Smile

CC(=C)N(C(=C)C)C(=O)C

DOS

IR

Vibrations