Geometry & MOs

Info

ID:	300221
PubChem CID:	121269875
Reduced:	BrN2O3C7H7 (1)
Stoich.:	AB2C3D7E7 (1)
Weight, g/mol:	245.964
ΔH_f, kcal/mol:	-62.27
Dipole, Da:	4.86
IP(EA), eV:	-9.53(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6-bromo-2-methylpyridin-3-yl) carbamoperoxoate

Drug info:

PubChemData

Smile

COC(=O)N(C1=CN=C(C=C1)Br)O

DOS

IR

Vibrations