Geometry & MOs

Info

ID:	389389
PubChem CID:	134992663
Reduced:	OC15H26 (1)
Stoich.:	AB15C26 (1)
Weight, g/mol:	270.06193
ΔH_f, kcal/mol:	-78.93
Dipole, Da:	2.23
IP(EA), eV:	-9.29(1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(8S)-5-bromo-4-butyltetracyclo[4.3.0.02,4.03,7]nonan-8-ol

Drug info:

PubChemData

Smile

CC\1([C@H]2CC[C@H](C2)/C1=C\CCC(C)(C)O)C

DOS

IR

Vibrations