Geometry & MOs

Info

ID:	265815
PubChem CID:	103549234
Reduced:	ClN3O3C12H16 (1)
Stoich.:	AB3C3D12E16 (1)
Weight, g/mol:	246.148061
ΔH_f, kcal/mol:	-41.15
Dipole, Da:	9.02
IP(EA), eV:	-9.07(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,6-dimethyl-2-(morpholin-3-ylmethylamino)pyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1NCC2COCCN2)Cl)[N+](=O)[O-]

DOS

IR

Vibrations