Geometry & MOs

Info

ID:	24091
PubChem CID:	607814
Reduced:	N2O3F6H12C15 (1)
Stoich.:	A2B3C6D12E15 (1)
Weight, g/mol:	382.075211
ΔH_f, kcal/mol:	-404.48
Dipole, Da:	7.06
IP(EA), eV:	-9.26(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[(2,2,2-trifluoroacetyl)amino]-3-[2-(trifluoromethyl)-1H-indol-3-yl]propanoate

Drug info:

PubChemData

Smile

COC(=O)C(CC1=C(NC2=CC=CC=C21)C(F)(F)F)NC(=O)C(F)(F)F

DOS

IR

Vibrations