Geometry & MOs

Info

ID:	141368
PubChem CID:	52869359
Reduced:	NOF3C14H16 (1)
Stoich.:	ABC3D14E16 (1)
Weight, g/mol:	351.155847
ΔH_f, kcal/mol:	-201.36
Dipole, Da:	5.87
IP(EA), eV:	-9.61(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-N-[(1S)-3-methyl-1-[3-(trifluoromethyl)phenyl]butyl]pyrazine-2-carboxamide

Drug info:

PubChemData

Smile

CC(=O)N1CCCC[C@@H]1C2=CC=C(C=C2)C(F)(F)F

DOS

IR

Vibrations