Geometry & MOs

Info

ID:	220359
PubChem CID:	85177340
Reduced:	O2C7H8 (2)
Stoich.:	A2B7C8 (2)
Weight, g/mol:	251.95527
ΔH_f, kcal/mol:	-148.93
Dipole, Da:	4.66
IP(EA), eV:	-9.02(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-bromocyclohex-2-en-1-yl) 2-chloroacetate

Drug info:

PubChemData

Smile

CCOC(=O)C1C2(CCCC3=C2C(=CC=C3)O1)O

DOS

IR

Vibrations