Geometry & MOs

Info

ID:	386571
PubChem CID:	134982184
Reduced:	ClOC13H17 (1)
Stoich.:	ABC13D17 (1)
Weight, g/mol:	296.180771
ΔH_f, kcal/mol:	-29.31
Dipole, Da:	3.62
IP(EA), eV:	-8.62(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC1(CC1Cl)CCC2=CC=C(C=C2)OC

DOS

IR

Vibrations