Geometry & MOs

Info

ID:	27262
PubChem CID:	819971
Reduced:	BrO5C11H11 (1)
Stoich.:	AB5C11D11 (1)
Weight, g/mol:	345.101082
ΔH_f, kcal/mol:	-165.03
Dipole, Da:	2.83
IP(EA), eV:	-9.5(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N,6-N-bis[(2S)-1-chlorobutan-2-yl]pyridine-2,6-dicarboxamide

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C(=C1)C=O)Br)OCC(=O)O

DOS

IR

Vibrations