Geometry & MOs

Info

ID:	378221
PubChem CID:	134224297
Reduced:	FN2O2H15C18 (1)
Stoich.:	AB2C2D15E18 (1)
Weight, g/mol:	370.136257
ΔH_f, kcal/mol:	-40.75
Dipole, Da:	3.73
IP(EA), eV:	-8.84(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-[(4-fluorophenyl)sulfonylamino]-3-methyl-N-[(2S)-4-methyl-1-oxopentan-2-yl]but-3-enamide

Drug info:

PubChemData

Smile

CN(C)C(=O)C1=CC2=C(C=C1)C=CN2C3=C(C=C(C=C3)C=O)F

DOS

IR

Vibrations