Geometry & MOs

Info

ID:	337168
PubChem CID:	127256733
Reduced:	Cl2N2S3C12H24 (1)
Stoich.:	A2B2C3D12E24 (1)
Weight, g/mol:	204.078644
ΔH_f, kcal/mol:	-86.56
Dipole, Da:	4.66
IP(EA), eV:	-8.9(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3Z,10R)-10-hydroxydodeca-3,11-dien-6,8-diynoic acid

Drug info:

PubChemData

Smile

CN1CCC2(CC1)SC3(CCN(CC3)C)SS2.Cl.Cl

DOS

IR

Vibrations