Geometry & MOs

Info

ID:	271382
PubChem CID:	103672520
Reduced:	OSBr2N2H8C11 (1)
Stoich.:	ABC2D2E8F11 (1)
Weight, g/mol:	413.88601
ΔH_f, kcal/mol:	36.05
Dipole, Da:	3.62
IP(EA), eV:	-9.35(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,5-dibromo-N-[1-(4-cyanophenyl)ethyl]thiophene-3-carboxamide

Drug info:

PubChemData

Smile

CC1=NC(=CC=C1)NC(=O)C2=C(SC(=C2)Br)Br

DOS

IR

Vibrations