Geometry & MOs

Info

ID:	259448
PubChem CID:	103165858
Reduced:	ClNO2C15H18 (1)
Stoich.:	ABC2D15E18 (1)
Weight, g/mol:	296.154308
ΔH_f, kcal/mol:	-76.31
Dipole, Da:	3.28
IP(EA), eV:	-9.19(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-chloro-2-(3-ethoxycyclobutyl)ethyl]-1-ethoxy-4-methylbenzene

Drug info:

PubChemData

Smile

CCN1C2=C(C=C(C=C2)C(CC3CCC3)Cl)OC1=O

DOS

IR

Vibrations