Geometry & MOs

Info

ID:	23838
PubChem CID:	606609
Reduced:	ON3C4H6 (2)
Stoich.:	AB3C4D6 (2)
Weight, g/mol:	224.102174
ΔH_f, kcal/mol:	38.85
Dipole, Da:	6.28
IP(EA), eV:	-9.56(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[4-(dimethylamino)-6-(methoxyamino)-1,3,5-triazin-2-yl]oxy]acetonitrile

Drug info:

PubChemData

Smile

CN(C)C1=NC(=NC(=N1)NOC)OCC#N

DOS

IR

Vibrations