Geometry & MOs

Info

ID:	386098
PubChem CID:	134980775
Reduced:	C5H7 (2)
Stoich.:	A5B7 (2)
Weight, g/mol:	175.110742
ΔH_f, kcal/mol:	40.42
Dipole, Da:	0.51
IP(EA), eV:	-9.62(1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,2S,4R,5R)-5-deuterio-1-phenylbicyclo[2.1.1]hexan-2-ol

Drug info:

PubChemData

Smile

C1C/C=C\2/CC2C3CC3C1

DOS

IR

Vibrations