Geometry & MOs

Info

ID:	284099
PubChem CID:	104036071
Reduced:	ClF2N3C14H14 (1)
Stoich.:	AB2C3D14E14 (1)
Weight, g/mol:	222.111676
ΔH_f, kcal/mol:	-56.91
Dipole, Da:	2.24
IP(EA), eV:	-8.48(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-aminopyridin-4-yl)morpholine-3-carboxamide

Drug info:

PubChemData

Smile

CCCNC1=NC=CC(=C1)NC2=C(C=C(C=C2Cl)F)F

DOS

IR

Vibrations