Geometry & MOs

Info

ID:	230160
PubChem CID:	87570326
Reduced:	ClFNSO5H19C20 (1)
Stoich.:	ABCDE5F19G20 (1)
Weight, g/mol:	119.073499
ΔH_f, kcal/mol:	-216.96
Dipole, Da:	8.6
IP(EA), eV:	-10.26(-1.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-cyclopenta-2,4-dien-1-ylideneprop-1-en-1-amine

Drug info:

PubChemData

Smile

CCC1=C(C=CC(=C1F)S(=O)(=O)C)C(=O)N2CCOC3=C(C2)C=C(C=C3)C(=O)Cl

DOS

IR

Vibrations