Geometry & MOs

Info

ID:	46288
PubChem CID:	10523739
Reduced:	BrN2O4H15C16 (1)
Stoich.:	AB2C4D15E16 (1)
Weight, g/mol:	379.064312
ΔH_f, kcal/mol:	-128.6
Dipole, Da:	3.6
IP(EA), eV:	-8.51(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2,2-trifluoro-N-[(2S)-1-[4-(trifluoromethyl)furo[2,3-f][1]benzofuran-8-yl]propan-2-yl]acetamide

Drug info:

PubChemData

Smile

C1[C@@H](C(=O)N(C1=O)CCC2=CNC3=CC=CC=C32)OC(=O)CBr

DOS

IR

Vibrations