Geometry & MOs

Info

ID:	264535
PubChem CID:	103469214
Reduced:	ON4C11H14 (1)
Stoich.:	AB4C11D14 (1)
Weight, g/mol:	232.132411
ΔH_f, kcal/mol:	19.78
Dipole, Da:	5.17
IP(EA), eV:	-8.4(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-6-[(2S,6R)-2,6-dimethylmorpholin-4-yl]pyridine-2-carbonitrile

Drug info:

PubChemData

Smile

C1CC(C1)(CNC2=NC(=C(C=C2)N)C#N)O

DOS

IR

Vibrations