Geometry & MOs

Info

ID:	22070
PubChem CID:	595938
Reduced:	C13H22 (1)
Stoich.:	A13B22 (1)
Weight, g/mol:	178.172151
ΔH_f, kcal/mol:	-54.22
Dipole, Da:	0.14
IP(EA), eV:	-9.94(3.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3,6-trimethyladamantane

Drug info:

PubChemData

Smile

CC1C2CC3(CC1CC(C2)(C3)C)C

DOS

IR

Vibrations