Geometry & MOs

Info

ID:	208487
PubChem CID:	80535491
Reduced:	NSBr2C14H21 (1)
Stoich.:	ABC2D14E21 (1)
Weight, g/mol:	223.90621
ΔH_f, kcal/mol:	9.51
Dipole, Da:	3.8
IP(EA), eV:	-9.16(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-2-(1-chloroethyl)thiophene

Drug info:

PubChemData

Smile

CCCNC(CC1CCCC1)C2=CC(=C(S2)Br)Br

DOS

IR

Vibrations