Geometry & MOs

Info

ID:	201023
PubChem CID:	79476257
Reduced:	OSN2C15H22 (1)
Stoich.:	ABC2D15E22 (1)
Weight, g/mol:	252.090804
ΔH_f, kcal/mol:	-0.28
Dipole, Da:	1.68
IP(EA), eV:	-8.63(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,3,3-trifluoro-2-N-methyl-2-N-(2-thiophen-2-ylethyl)propane-1,2-diamine

Drug info:

PubChemData

Smile

CC1=CC=C(O1)C(C(C)N)N(C)CCC2=CC=CS2

DOS

IR

Vibrations