Geometry & MOs

Info

ID:	339488
PubChem CID:	127261421
Reduced:	BrOC10H19 (1)
Stoich.:	ABC10D19 (1)
Weight, g/mol:	234.06193
ΔH_f, kcal/mol:	-89.93
Dipole, Da:	2.3
IP(EA), eV:	-9.58(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,5S)-2-(2-bromopropan-2-yl)-5-propan-2-yloxolane

Drug info:

PubChemData

Smile

CC(C)[C@H]1CC[C@H](O1)C(C)(C)Br

DOS

IR

Vibrations