Geometry & MOs

Info

ID:	257671
PubChem CID:	103147830
Reduced:	F2O2C13H18 (1)
Stoich.:	A2B2C13D18 (1)
Weight, g/mol:	313.97877
ΔH_f, kcal/mol:	-190.63
Dipole, Da:	2.57
IP(EA), eV:	-9.49(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-bromothiophen-2-yl)-4-(2,2-difluoroethoxy)butan-2-ol

Drug info:

PubChemData

Smile

CCC1=CC(=CC=C1)C(CCOCC(F)F)O

DOS

IR

Vibrations