Geometry & MOs

Info

ID:	197427
PubChem CID:	78965646
Reduced:	O2N3C15H17 (1)
Stoich.:	A2B3C15D17 (1)
Weight, g/mol:	350.93132
ΔH_f, kcal/mol:	-51.03
Dipole, Da:	7.82
IP(EA), eV:	-8.86(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-N-(4-cyano-2-nitrophenyl)thiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)C1(CC(=O)N(C1=O)C2=C(C=C(C=C2)C#N)N)C

DOS

IR

Vibrations