Geometry & MOs

Info

ID:	424470
PubChem CID:	135122804
Reduced:	F3N3O3H12C14 (1)
Stoich.:	A3B3C3D12E14 (1)
Weight, g/mol:	421.92785
ΔH_f, kcal/mol:	-182.26
Dipole, Da:	7.22
IP(EA), eV:	-8.77(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

11,12,12-tribromododecan-1-ol

Drug info:

PubChemData

Smile

CN(C1=CC=C(C=C1)OC(F)(F)F)C2=NN=C(C=C2)OCC=O

DOS

IR

Vibrations