Geometry & MOs

Info

ID:	204948
PubChem CID:	80035555
Reduced:	N2O2F3C14H17 (1)
Stoich.:	A2B2C3D14E17 (1)
Weight, g/mol:	302.124212
ΔH_f, kcal/mol:	-238.69
Dipole, Da:	2.98
IP(EA), eV:	-8.92(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-N-methyl-N-(oxan-4-yl)-5-(trifluoromethyl)benzamide

Drug info:

PubChemData

Smile

CNC1=C(C=C(C=C1)C(F)(F)F)C(=O)NC2CCOCC2

DOS

IR

Vibrations