Geometry & MOs

Info

ID:	20753
PubChem CID:	585530
Reduced:	S2C11H16 (1)
Stoich.:	A2B11C16 (1)
Weight, g/mol:	212.069343
ΔH_f, kcal/mol:	0.82
Dipole, Da:	3.52
IP(EA), eV:	-8.8(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

adamantane-1-carbodithioic acid

Drug info:

PubChemData

Smile

C1C2CC3CC1CC(C2)(C3)C(=S)S

DOS

IR

Vibrations