Geometry & MOs

Info

ID:	357273
PubChem CID:	127293906
Reduced:	F3N3O4C14H14 (1)
Stoich.:	A3B3C4D14E14 (1)
Weight, g/mol:	382.16166
ΔH_f, kcal/mol:	-263.25
Dipole, Da:	7.78
IP(EA), eV:	-9.2(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-pyrrolidin-1-yl-N-[2-(trifluoromethyl)-1,3-benzoxazol-5-yl]piperidine-1-carboxamide

Drug info:

PubChemData

Smile

C1COC(CO1)CNC(=O)NC2=CC3=C(C=C2)OC(=N3)C(F)(F)F

DOS

IR

Vibrations