Geometry & MOs

Info

ID:	379927
PubChem CID:	134964339
Reduced:	O3C10H14 (1)
Stoich.:	A3B10C14 (1)
Weight, g/mol:	234.17911
ΔH_f, kcal/mol:	-95.52
Dipole, Da:	1.96
IP(EA), eV:	-9.57(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-4-[(2S)-but-3-en-2-yl]-2,9,9-trimethyl-3,5-dioxa-4-boratricyclo[6.1.1.02,6]decane

Drug info:

PubChemData

Smile

C[C@@H]([C@H](C=C)O)[C@@H](C1=CC=CO1)O

DOS

IR

Vibrations