Geometry & MOs

Info

ID:	271298
PubChem CID:	103654275
Reduced:	N2O2C15H24 (1)
Stoich.:	A2B2C15D24 (1)
Weight, g/mol:	272.152478
ΔH_f, kcal/mol:	-92.1
Dipole, Da:	2.64
IP(EA), eV:	-10.01(0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-cyano-N-[(4-ethylphenyl)methyl]oxane-4-carboxamide

Drug info:

PubChemData

Smile

C1CCC(C1)CCCNC(=O)C2(CCOCC2)C#N

DOS

IR

Vibrations