Geometry & MOs

Info

ID:	389950
PubChem CID:	134996166
Reduced:	NBr4C10H13 (1)
Stoich.:	AB4C10D13 (1)
Weight, g/mol:	228.118401
ΔH_f, kcal/mol:	23.3
Dipole, Da:	3.4
IP(EA), eV:	-8.73(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (3S)-4-tert-butyl-2,2-dimethyl-3H-thiophene-3-carboxylate

Drug info:

PubChemData

Smile

CCCCN/C=C(\C(=C(/C(=C)Br)\Br)\Br)/Br

DOS

IR

Vibrations