Geometry & MOs

Info

ID:	389591
PubChem CID:	134993922
Reduced:	PBr2C6H15 (1)
Stoich.:	AB2C6D15 (1)
Weight, g/mol:	168.11503
ΔH_f, kcal/mol:	-61.84
Dipole, Da:	5.69
IP(EA), eV:	-9.01(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (1R,2R)-1,2-dimethylcyclohex-3-ene-1-carboxylate

Drug info:

PubChemData

Smile

CCCCP(C)(C)(Br)Br

DOS

IR

Vibrations