Geometry & MOs

Info

ID:	15092
PubChem CID:	429253
Reduced:	BrC13H21 (1)
Stoich.:	AB13C21 (1)
Weight, g/mol:	256.08266
ΔH_f, kcal/mol:	-62.41
Dipole, Da:	3.58
IP(EA), eV:	-10.14(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-bromo-3,5,7-trimethyladamantane

Drug info:

PubChemData

Smile

CC12CC3(CC(C1)(CC(C2)(C3)Br)C)C

DOS

IR

Vibrations