Geometry & MOs

Info

ID:	157981
PubChem CID:	56459370
Reduced:	FO2N6C25H27 (1)
Stoich.:	AB2C6D25E27 (1)
Weight, g/mol:	428.184841
ΔH_f, kcal/mol:	-15.87
Dipole, Da:	2.39
IP(EA), eV:	-8.92(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(3-cyanopyridin-2-yl)oxy-2-methylphenyl]-3-(morpholin-4-ylmethyl)benzamide

Drug info:

PubChemData

Smile

C1COCCN1CC2=CC(=CC=C2)C(=O)NCCCC3=NN(C(=C3C#N)N)C4=CC=C(C=C4)F

DOS

IR

Vibrations