Geometry & MOs

Info

ID:	282571
PubChem CID:	103931441
Reduced:	NO2C12H25 (1)
Stoich.:	AB2C12D25 (1)
Weight, g/mol:	286.99795
ΔH_f, kcal/mol:	-113.07
Dipole, Da:	1.67
IP(EA), eV:	-9.05(2.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-2-(oxolan-2-ylmethylsulfanylmethyl)pyridine

Drug info:

PubChemData

Smile

CCOC1CC(C1)NCCOC(C)(C)C

DOS

IR

Vibrations