Geometry & MOs

Info

ID:	331717
PubChem CID:	127249800
Reduced:	FO2N6C21H21 (1)
Stoich.:	AB2C6D21E21 (1)
Weight, g/mol:	407.19574
ΔH_f, kcal/mol:	-31.92
Dipole, Da:	2.22
IP(EA), eV:	-8.79(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-methyl-3-propan-2-yl-1,2-oxazol-4-yl)-[2-[6-(pyridin-2-ylamino)pyridin-2-yl]morpholin-4-yl]methanone

Drug info:

PubChemData

Smile

CC1=NC(=NC=C1C(=O)N2CCOC(C2)C3=NC(=CC=C3)NC4=NC=C(C=C4)F)C

DOS

IR

Vibrations