Geometry & MOs

Info

ID:	207951
PubChem CID:	80474069
Reduced:	BrSO2C9H13 (1)
Stoich.:	ABC2D9E13 (1)
Weight, g/mol:	319.90735
ΔH_f, kcal/mol:	-74.57
Dipole, Da:	2.37
IP(EA), eV:	-9.07(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-bromothiophen-2-yl)-(3-chloro-2-fluorophenyl)methanol

Drug info:

PubChemData

Smile

CCOC(C)C(C1=C(C=CS1)Br)O

DOS

IR

Vibrations