Geometry & MOs

Info

ID:	297475
PubChem CID:	117618616
Reduced:	BrN2C9H11 (1)
Stoich.:	AB2C9D11 (1)
Weight, g/mol:	237.172879
ΔH_f, kcal/mol:	70.11
Dipole, Da:	2.58
IP(EA), eV:	-9.3(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-ethoxy-2,2-dimethyl-3-pyridin-2-ylpentan-3-ol

Drug info:

PubChemData

Smile

C1CC1C2=C(C(=NN2)C3CC3)Br

DOS

IR

Vibrations