Geometry & MOs

Info

ID:	280447
PubChem CID:	103849346
Reduced:	O3N4C14H18 (1)
Stoich.:	A3B4C14D18 (1)
Weight, g/mol:	307.083156
ΔH_f, kcal/mol:	-78.17
Dipole, Da:	2.14
IP(EA), eV:	-9.37(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-fluoro-N-[(3-hydroxyoxolan-3-yl)methyl]-3-(trifluoromethyl)benzamide

Drug info:

PubChemData

Smile

CC1=NN2C(=C(C=NC2=C1)C(=O)NCC3(CCOC3)O)C

DOS

IR

Vibrations