Geometry & MOs

Info

ID:	275496
PubChem CID:	103816449
Reduced:	BrClON2H10C11 (1)
Stoich.:	ABCD2E10F11 (1)
Weight, g/mol:	319.95633
ΔH_f, kcal/mol:	12.0
Dipole, Da:	8.13
IP(EA), eV:	-9.12(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-bromo-6-chloropyridin-3-yl)-1,4-dioxane-2-carboxamide

Drug info:

PubChemData

Smile

CC=CC=CC(=O)NC1=CC(=C(N=C1)Cl)Br

DOS

IR

Vibrations