Geometry & MOs

Info

ID:	257877
PubChem CID:	103148936
Reduced:	BrNF2O2C14H18 (1)
Stoich.:	ABC2D2E14F18 (1)
Weight, g/mol:	269.045269
ΔH_f, kcal/mol:	-171.56
Dipole, Da:	2.65
IP(EA), eV:	-8.76(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-chlorothiophen-2-yl)-4-(2,2-difluoroethoxy)butan-2-amine

Drug info:

PubChemData

Smile

C1COC2=C1C=C(C=C2CC(CCOCC(F)F)N)Br

DOS

IR

Vibrations