Geometry & MOs

Info

ID:	288418
PubChem CID:	104316470
Reduced:	NO2C11H17 (1)
Stoich.:	AB2C11D17 (1)
Weight, g/mol:	338.92925
ΔH_f, kcal/mol:	-87.64
Dipole, Da:	2.39
IP(EA), eV:	-8.0(0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-amino-2,6-dibromophenoxy)butan-2-ol

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)N)OCCC(C)O

DOS

IR

Vibrations