Geometry & MOs

Info

ID:	153898
PubChem CID:	56313234
Reduced:	F3N3O4C23H26 (1)
Stoich.:	A3B3C4D23E26 (1)
Weight, g/mol:	474.103162
ΔH_f, kcal/mol:	-278.22
Dipole, Da:	1.62
IP(EA), eV:	-9.17(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(3-methyl-1,2-oxazole-5-carbonyl)piperazine-1-carbonyl]-N-(4-methylphenyl)thiophene-3-sulfonamide

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)CCC(=O)NC2CCN(CC2)C(=O)C3=CC=NC=C3)OCC(F)(F)F

DOS

IR

Vibrations