Geometry & MOs

Info

ID:	342548
PubChem CID:	127265703
Reduced:	N2O3C12H16 (1)
Stoich.:	A2B3C12D16 (1)
Weight, g/mol:	300.01095
ΔH_f, kcal/mol:	-44.39
Dipole, Da:	3.09
IP(EA), eV:	-9.87(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-1-hex-3-enyl-3-nitropyridin-2-one

Drug info:

PubChemData

Smile

CCC=CCCN1C=C(C(=CC1=O)C)[N+](=O)[O-]

DOS

IR

Vibrations