Geometry & MOs

Info

ID:	146420
PubChem CID:	53687538
Reduced:	NO3F6H11C14 (1)
Stoich.:	AB3C6D11E14 (1)
Weight, g/mol:	158.032757
ΔH_f, kcal/mol:	-428.75
Dipole, Da:	7.0
IP(EA), eV:	-9.67(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,5-dinitropenta-1,3-diene

Drug info:

PubChemData

Smile

COC(=O)C1CC(=O)N(C1)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

DOS

IR

Vibrations