Geometry & MOs

Info

ID:	268032
PubChem CID:	103597456
Reduced:	SN3O3C21H23 (1)
Stoich.:	AB3C3D21E23 (1)
Weight, g/mol:	368.094312
ΔH_f, kcal/mol:	-36.49
Dipole, Da:	1.94
IP(EA), eV:	-8.47(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]pyridin-2-yl]morpholine

Drug info:

PubChemData

Smile

COC1=C(C(=C(C=C1)C2=CSC(=N2)C3=CC(=NC=C3)N4CCCCC4)OC)O

DOS

IR

Vibrations