Geometry & MOs

Info

ID:	144448
PubChem CID:	53369541
Reduced:	O2N4C21H22 (1)
Stoich.:	A2B4C21D22 (1)
Weight, g/mol:	359.087453
ΔH_f, kcal/mol:	24.11
Dipole, Da:	5.96
IP(EA), eV:	-8.93(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-2-pyridin-4-yl-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

CC(C)N1C2=NC(=O)CC(C2=CN1)C3=CC=C(C=C3)OCC4=CC=CC=N4

DOS

IR

Vibrations