Geometry & MOs

Info

ID:	207950
PubChem CID:	80474014
Reduced:	N2O3C16H20 (1)
Stoich.:	A2B3C16D20 (1)
Weight, g/mol:	263.98196
ΔH_f, kcal/mol:	-97.75
Dipole, Da:	4.99
IP(EA), eV:	-8.2(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-bromothiophen-2-yl)-2-ethoxypropan-1-ol

Drug info:

PubChemData

Smile

CC(=O)NC1=CC(=C(C=C1)OC)NC(=O)C2CC3CC3C2

DOS

IR

Vibrations