Geometry & MOs

Info

ID:	279546
PubChem CID:	103844293
Reduced:	SO2N4C12H14 (1)
Stoich.:	AB2C4D12E14 (1)
Weight, g/mol:	274.10659
ΔH_f, kcal/mol:	54.32
Dipole, Da:	4.26
IP(EA), eV:	-8.9(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(cyclopenten-1-yl)ethyl]-4-nitro-2,1,3-benzoxadiazol-7-amine

Drug info:

PubChemData

Smile

C1CC=C(C1)CCNC2=C(N3C=CSC3=N2)[N+](=O)[O-]

DOS

IR

Vibrations