Geometry & MOs

Info

ID:	373729
PubChem CID:	131319431
Reduced:	BO2N3C6H10 (1)
Stoich.:	AB2C3D6E10 (1)
Weight, g/mol:	274.97932
ΔH_f, kcal/mol:	-90.28
Dipole, Da:	2.01
IP(EA), eV:	-9.7(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-bromo-4-(dimethoxymethyl)pyridine-2-carboxylic acid

Drug info:

PubChemData

Smile

B(C1=CN(N=C1)C2CNC2)(O)O

DOS

IR

Vibrations