Geometry & MOs

Info

ID:	259431
PubChem CID:	103165712
Reduced:	BrC16H23 (1)
Stoich.:	AB16C23 (1)
Weight, g/mol:	338.12453
ΔH_f, kcal/mol:	-13.08
Dipole, Da:	2.65
IP(EA), eV:	-9.2(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-bromo-2-(3-ethoxycyclobutyl)ethyl]-4-(2-methylpropyl)benzene

Drug info:

PubChemData

Smile

CC(C)CC1=CC=C(C=C1)C(CC2CCC2)Br

DOS

IR

Vibrations