Geometry & MOs

Info

ID:	271300
PubChem CID:	103654277
Reduced:	N2O3C8H12 (1)
Stoich.:	A2B3C8D12 (1)
Weight, g/mol:	288.147393
ΔH_f, kcal/mol:	-67.91
Dipole, Da:	2.32
IP(EA), eV:	-9.9(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-cyano-N-[2-(3-methoxyphenyl)ethyl]oxane-4-carboxamide

Drug info:

PubChemData

Smile

CONC(=O)C1(CCOCC1)C#N

DOS

IR

Vibrations