Geometry & MOs

Info

ID:	385322
PubChem CID:	134978789
Reduced:	BOC10H21 (1)
Stoich.:	ABC10D21 (1)
Weight, g/mol:	236.098491
ΔH_f, kcal/mol:	-108.72
Dipole, Da:	1.3
IP(EA), eV:	-9.21(1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

B(CC)(CC)O/C(=C\CC)/CC

DOS

IR

Vibrations