Geometry & MOs

Info

ID:	211731
PubChem CID:	81051433
Reduced:	N2O3C12H18 (1)
Stoich.:	A2B3C12D18 (1)
Weight, g/mol:	219.137162
ΔH_f, kcal/mol:	-126.48
Dipole, Da:	6.73
IP(EA), eV:	-9.29(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-amino-2-methylpropoxy)-2,6-dimethylpyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CCOCCNC1=C(C(=NC(=C1)C)C)C(=O)O

DOS

IR

Vibrations