Geometry & MOs

Info

ID:	202360
PubChem CID:	79663376
Reduced:	ON4C14H20 (1)
Stoich.:	AB4C14D20 (1)
Weight, g/mol:	274.142976
ΔH_f, kcal/mol:	19.81
Dipole, Da:	3.8
IP(EA), eV:	-9.3(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[5-amino-2-(dimethylamino)benzoyl]morpholine-2-carbonitrile

Drug info:

PubChemData

Smile

CCC(C(C1=CC=CC=N1)N2CCOC(C2)C#N)N

DOS

IR

Vibrations