Geometry & MOs

Info

ID:	398234
PubChem CID:	135032395
Reduced:	NO2C9H11 (2)
Stoich.:	AB2C9D11 (2)
Weight, g/mol:	182.167065
ΔH_f, kcal/mol:	-93.99
Dipole, Da:	2.01
IP(EA), eV:	-9.69(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-ethoxyethyl)-3-[(E)-prop-1-enyl]cyclopentane

Drug info:

PubChemData

Smile

C1=CC(=C(NCCOCCOCCNC(=C2C=CC=C2)[O-])[O-])C=C1

DOS

IR

Vibrations