Geometry & MOs

Info

ID:	197108
PubChem CID:	78922712
Reduced:	N2F3O3C11H15 (1)
Stoich.:	A2B3C3D11E15 (1)
Weight, g/mol:	291.194677
ΔH_f, kcal/mol:	-273.91
Dipole, Da:	3.62
IP(EA), eV:	-10.09(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[2-(tert-butylamino)acetyl]amino]-N-ethyl-3-methylbenzamide

Drug info:

PubChemData

Smile

C1C[C@@H](N(C1)C(=O)N(CC(F)(F)F)C2CC2)C(=O)O

DOS

IR

Vibrations