Geometry & MOs

Info

ID:	77586
PubChem CID:	49655572
Reduced:	ClN2O6H19C21 (1)
Stoich.:	AB2C6D19E21 (1)
Weight, g/mol:	346.109962
ΔH_f, kcal/mol:	-143.51
Dipole, Da:	9.07
IP(EA), eV:	-8.99(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[(4-methyl-1,3-thiazol-2-yl)carbamoyl]phenyl]morpholine-4-carboxamide

Drug info:

PubChemData

Smile

COC1=C(C(=C(C=C1)C2=NOC3(C2)CC(=O)N(C3=O)C4=CC=C(C=C4)Cl)OC)OC

DOS

IR

Vibrations