Geometry & MOs

Info

ID:	17754
PubChem CID:	517225
Reduced:	NBr2O2C12H19 (1)
Stoich.:	AB2C2D12E19 (1)
Weight, g/mol:	368.9762
ΔH_f, kcal/mol:	-88.21
Dipole, Da:	3.71
IP(EA), eV:	-9.28(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-aminoethanol;2,6-dibromo-4-tert-butylphenol

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC(=C(C(=C1)Br)O)Br.C(CO)N

DOS

IR

Vibrations