Geometry & MOs

Info

ID:	406650
PubChem CID:	135078251
Reduced:	NO2H15C16 (1)
Stoich.:	AB2C15D16 (1)
Weight, g/mol:	248.04119
ΔH_f, kcal/mol:	26.23
Dipole, Da:	2.75
IP(EA), eV:	-8.84(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,3R)-3-bromo-2-(3-methylbut-2-enoxy)oxane

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)/C=C/COC2=CC=CC=C2/C=N/O

DOS

IR

Vibrations