Geometry & MOs

Info

ID:	264592
PubChem CID:	103473253
Reduced:	O3N4C11H12 (1)
Stoich.:	A3B4C11D12 (1)
Weight, g/mol:	278.101505
ΔH_f, kcal/mol:	19.41
Dipole, Da:	9.04
IP(EA), eV:	-9.87(-1.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[(6-methylmorpholin-2-yl)methoxy]-5-nitropyridine-3-carbonitrile

Drug info:

PubChemData

Smile

C1CC(NC1)COC2=NC(=C(C=C2)[N+](=O)[O-])C#N

DOS

IR

Vibrations