Geometry & MOs

Info

ID:	373736
PubChem CID:	131319483
Reduced:	IN2O4H7C8 (1)
Stoich.:	AB2C4D7E8 (1)
Weight, g/mol:	262.93487
ΔH_f, kcal/mol:	-54.82
Dipole, Da:	6.08
IP(EA), eV:	-9.4(-1.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-bromo-4-chloropyridin-3-yl)methyl acetate

Drug info:

PubChemData

Smile

C1=C(C=C(C(=C1CC(=O)O)I)N)[N+](=O)[O-]

DOS

IR

Vibrations