Geometry & MOs

Info

ID:	62676
PubChem CID:	26732713
Reduced:	SN2O2F3C25H29 (1)
Stoich.:	AB2C2D3E25F29 (1)
Weight, g/mol:	391.103142
ΔH_f, kcal/mol:	-235.54
Dipole, Da:	6.75
IP(EA), eV:	-9.13(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-oxochromen-7-yl)oxy-N-[2-[4-(trifluoromethyl)phenyl]ethyl]acetamide

Drug info:

PubChemData

Smile

C1CCC(CC1)CNC(=O)CSC2=CC=CC=C2C(=O)NCCC3=CC=C(C=C3)C(F)(F)F

DOS

IR

Vibrations