Geometry & MOs

Info

ID:	400627
PubChem CID:	135048547
Reduced:	BO4C18H33 (1)
Stoich.:	AB4C18D33 (1)
Weight, g/mol:	345.222166
ΔH_f, kcal/mol:	-152.24
Dipole, Da:	1.0
IP(EA), eV:	-9.36(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,3R)-3-deuterio-2-phenylmethoxy-3-[(2S,6R)-2,9,9-trimethyl-3,5-dioxa-4-boratricyclo[6.1.1.02,6]decan-4-yl]propan-1-ol

Drug info:

PubChemData

Smile

B(C1CCCCC1)(OOC2CCCCC2)OOC3CCCCC3

DOS

IR

Vibrations