Geometry & MOs

Info

ID:	146144
PubChem CID:	53643480
Reduced:	NOC3H3 (4)
Stoich.:	ABC3D3 (4)
Weight, g/mol:	186.125594
ΔH_f, kcal/mol:	-15.81
Dipole, Da:	3.35
IP(EA), eV:	-10.37(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-pentoxyethyl prop-2-enoate

Drug info:

PubChemData

Smile

COC1=NC(=NC(=N1)CC2=CC=CC=C2[N+](=O)[O-])OC

DOS

IR

Vibrations