Geometry & MOs

Info

ID:	48949
PubChem CID:	11528512
Reduced:	BrO3C5H7 (1)
Stoich.:	AB3C5D7 (1)
Weight, g/mol:	195.064391
ΔH_f, kcal/mol:	-133.89
Dipole, Da:	3.76
IP(EA), eV:	-10.81(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(hydroxymethyl)pyridine-2,6-dicarboxamide

Drug info:

PubChemData

Smile

C1[C@H]([C@H](OC1=O)CBr)O

DOS

IR

Vibrations