Geometry & MOs

Info

ID:	326401
PubChem CID:	126687479
Reduced:	FO2N3H12C17 (1)
Stoich.:	AB2C3D12E17 (1)
Weight, g/mol:	187.076392
ΔH_f, kcal/mol:	-17.24
Dipole, Da:	4.14
IP(EA), eV:	-9.52(-1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(E)-1-chloroprop-1-enyl]-N-methoxycyclopenten-1-amine

Drug info:

PubChemData

Smile

CCC1=C(N2C=CC=CC2=N1)C(=O)C3=CC(=C(C(=C3)F)O)C#N

DOS

IR

Vibrations