Geometry & MOs

Info

ID:	297114
PubChem CID:	117609572
Reduced:	O2F3N7C23H24 (1)
Stoich.:	A2B3C7D23E24 (1)
Weight, g/mol:	320.104003
ΔH_f, kcal/mol:	-115.97
Dipole, Da:	4.81
IP(EA), eV:	-8.48(-1.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(5-amino-2-chloropyridin-3-yl)-1-methyl-3-morpholin-4-ylpyridin-2-one

Drug info:

PubChemData

Smile

CC1=C(C=C(C=N1)NC(=O)C2=CC(=NN=C2)C(F)(F)F)C3=CC(=C(N=C3)N(C)C)N4CCOCC4

DOS

IR

Vibrations