Geometry & MOs

Info

ID:	250446
PubChem CID:	103096688
Reduced:	BrN2O2C12H19 (1)
Stoich.:	AB2C2D12E19 (1)
Weight, g/mol:	252.054419
ΔH_f, kcal/mol:	-67.94
Dipole, Da:	2.54
IP(EA), eV:	-9.17(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,3,3-trifluoro-2-methyl-2-(thiophen-2-ylmethylamino)propanamide

Drug info:

PubChemData

Smile

CC(C1=CC=C(O1)Br)NCC(C)(C)C(=O)NC

DOS

IR

Vibrations