Geometry & MOs

Info

ID:	399028
PubChem CID:	135037139
Reduced:	BrO3C12H21 (1)
Stoich.:	AB3C12D21 (1)
Weight, g/mol:	196.99032
ΔH_f, kcal/mol:	-171.22
Dipole, Da:	2.3
IP(EA), eV:	-10.11(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCC1CC(CC(O1)C2COC(O2)(C)C)Br

DOS

IR

Vibrations