Geometry & MOs

Info

ID:	367070
PubChem CID:	127323055
Reduced:	O3N4C15H16 (1)
Stoich.:	A3B4C15D16 (1)
Weight, g/mol:	378.082033
ΔH_f, kcal/mol:	-9.05
Dipole, Da:	2.35
IP(EA), eV:	-8.72(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-2-[4-[(2-methyl-1,3-thiazol-4-yl)sulfonyl]piperazin-1-yl]-1,3-benzoxazole

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)OC(=N2)N3CCOC(C3)C4=NOC(=N4)C

DOS

IR

Vibrations