Geometry & MOs

Info

ID:	331679
PubChem CID:	127249762
Reduced:	ON6C24H26 (1)
Stoich.:	AB6C24D26 (1)
Weight, g/mol:	378.180424
ΔH_f, kcal/mol:	83.97
Dipole, Da:	1.44
IP(EA), eV:	-8.16(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1,3-dimethylpyrazol-4-yl)-[2-[6-(pyridin-2-ylamino)pyridin-2-yl]morpholin-4-yl]methanone

Drug info:

PubChemData

Smile

CC1=CC(=NN1C)NC2=CC=CC(=N2)C3CN(CCO3)CC4=CC5=C(C=C4)N=CC=C5

DOS

IR

Vibrations