Geometry & MOs

Info

ID:	264577
PubChem CID:	103471639
Reduced:	SO2N4H8C11 (1)
Stoich.:	AB2C4D8E11 (1)
Weight, g/mol:	290.13789
ΔH_f, kcal/mol:	94.37
Dipole, Da:	10.45
IP(EA), eV:	-9.69(-1.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(2-cyclohexyloxyethylamino)-3-nitropyridine-2-carbonitrile

Drug info:

PubChemData

Smile

C1=CC(=NC(=C1[N+](=O)[O-])C#N)NCC2=CSC=C2

DOS

IR

Vibrations