Geometry & MOs

Info

ID:	197272
PubChem CID:	78945708
Reduced:	N2O3C15H18 (1)
Stoich.:	A2B3C15D18 (1)
Weight, g/mol:	252.071034
ΔH_f, kcal/mol:	-73.32
Dipole, Da:	6.8
IP(EA), eV:	-8.9(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,3-difluorobenzoyl)morpholine-2-carbonitrile

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)CCC(=O)N2CCOC(C2)C#N

DOS

IR

Vibrations