Geometry & MOs

Info

ID:	331692
PubChem CID:	127249775
Reduced:	O3N6C19H20 (1)
Stoich.:	A3B6C19D20 (1)
Weight, g/mol:	414.14741
ΔH_f, kcal/mol:	-15.27
Dipole, Da:	3.39
IP(EA), eV:	-9.37(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,4-dimethyl-1,3-oxazol-5-yl)-[2-[6-[(5-ethyl-1,3,4-thiadiazol-2-yl)amino]pyridin-2-yl]morpholin-4-yl]methanone

Drug info:

PubChemData

Smile

CC1=C(OC(=N1)C)C(=O)N2CCOC(C2)C3=NC(=CC=C3)NC4=NC=CC=N4

DOS

IR

Vibrations