Geometry & MOs

Info

ID:	399905
PubChem CID:	135043690
Reduced:	NO3C14H17 (1)
Stoich.:	AB3C14D17 (1)
Weight, g/mol:	156.081324
ΔH_f, kcal/mol:	-47.32
Dipole, Da:	3.94
IP(EA), eV:	-9.49(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

2-cyclopenta-2,4-dien-1-ylaniline

Drug info:

PubChemData

Smile

C1C[C@H]([C@H](C1)[N+](=O)[O-])CC(=O)CC2=CC=CC=C2

DOS

IR

Vibrations