Geometry & MOs

Info

ID:	123236
PubChem CID:	50838902
Reduced:	O2N4C19H26 (1)
Stoich.:	A2B4C19D26 (1)
Weight, g/mol:	479.112662
ΔH_f, kcal/mol:	-57.38
Dipole, Da:	1.37
IP(EA), eV:	-8.58(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-methyl-5-[(Z)-2-[4-[[3-(trifluoromethyl)phenyl]sulfamoyl]phenyl]ethenyl]-1,2-oxazol-4-yl]propanamide

Drug info:

PubChemData

Smile

CC1=NN(C2=C1C=CN(C2=O)C(C)C(=O)NCCC3=CCCCC3)C

DOS

IR

Vibrations