Geometry & MOs

Info

ID:	206066
PubChem CID:	80196713
Reduced:	BrN2C11H15 (1)
Stoich.:	AB2C11D15 (1)
Weight, g/mol:	270.06193
ΔH_f, kcal/mol:	13.28
Dipole, Da:	3.45
IP(EA), eV:	-9.26(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-bromo-2-methylpropyl)-3-propan-2-yloxybenzene

Drug info:

PubChemData

Smile

CC1(CCNC2=C(N1)C=C(C=C2)Br)C

DOS

IR

Vibrations