Geometry & MOs

Info

ID:	20706
PubChem CID:	585304
Reduced:	F3N3O4C18H18 (1)
Stoich.:	A3B3C4D18E18 (1)
Weight, g/mol:	397.124941
ΔH_f, kcal/mol:	-243.8
Dipole, Da:	3.19
IP(EA), eV:	-8.75(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3,3,3-trifluoro-2-[(2-methoxybenzoyl)amino]-2-(2-phenylhydrazinyl)propanoate

Drug info:

PubChemData

Smile

COC1=CC=CC=C1C(=O)NC(C(=O)OC)(C(F)(F)F)NNC2=CC=CC=C2

DOS

IR

Vibrations