Geometry & MOs

Info

ID:	227603
PubChem CID:	87562072
Reduced:	ON3H9C12 (1)
Stoich.:	AB3C9D12 (1)
Weight, g/mol:	317.175084
ΔH_f, kcal/mol:	84.04
Dipole, Da:	1.72
IP(EA), eV:	-8.64(-1.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3Z)-3-amino-3-(cyclopentanecarbonyloxyimino)propyl]-(1-fluorobutyl)carbamic acid

Drug info:

PubChemData

Smile

C1=C/C(=C\2/C3=C(C=C(C=C3)C=O)NN2)/N=C1

DOS

IR

Vibrations