Geometry & MOs

Info

ID:	359297
PubChem CID:	127298229
Reduced:	ON2C11H17 (2)
Stoich.:	AB2C11D17 (2)
Weight, g/mol:	335.141596
ΔH_f, kcal/mol:	-84.02
Dipole, Da:	1.84
IP(EA), eV:	-8.59(0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4-dimethyl-N-[1-(2-morpholin-4-ylethyl)pyrazol-3-yl]-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

CC12CC3CC(C1)(CC(C3)(C2)C(=O)NC4=NN(C=C4)CCN5CCOCC5)C

DOS

IR

Vibrations