Geometry & MOs

Info

ID:	331671
PubChem CID:	127249754
Reduced:	O2N5H21C24 (1)
Stoich.:	A2B5C21D24 (1)
Weight, g/mol:	430.124566
ΔH_f, kcal/mol:	42.9
Dipole, Da:	5.15
IP(EA), eV:	-8.52(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1COC(CN1C(=O)C2=CC=CC3=C2N=CC=C3)C4=NC(=CC=C4)NC5=CC=CC=N5

DOS

IR

Vibrations