Geometry & MOs

Info

ID:	385673
PubChem CID:	134979697
Reduced:	C17H26 (1)
Stoich.:	A17B26 (1)
Weight, g/mol:	156.181608
ΔH_f, kcal/mol:	-5.04
Dipole, Da:	0.71
IP(EA), eV:	-9.21(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-tert-butyl-2,3,5,6-tetradeuteriobicyclo[2.2.1]heptane

Drug info:

PubChemData

Smile

CCCC[C@@H]1[C@@H](C1C2=CC=CC=C2)CCCC

DOS

IR

Vibrations