Geometry & MOs

Info

ID:	374190
PubChem CID:	131325285
Reduced:	O2N3C5H5 (1)
Stoich.:	A2B3C5D5 (1)
Weight, g/mol:	150.054161
ΔH_f, kcal/mol:	16.04
Dipole, Da:	4.23
IP(EA), eV:	-11.22(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(6-aminopyrimidin-4-yl)oxyacetonitrile

Drug info:

PubChemData

Smile

C(CO)C1=NC(=NO1)C#N

DOS

IR

Vibrations