Geometry & MOs

Info

ID:	197338
PubChem CID:	78953502
Reduced:	O2N3C15H25 (1)
Stoich.:	A2B3C15D25 (1)
Weight, g/mol:	249.111341
ΔH_f, kcal/mol:	-77.15
Dipole, Da:	2.7
IP(EA), eV:	-8.92(0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-cyanooxane-4-carbonyl)morpholine-2-carbonitrile

Drug info:

PubChemData

Smile

CN(C)C1(CCCC1)CNC(=O)C2(CCOCC2)C#N

DOS

IR

Vibrations