Geometry & MOs

Info

ID:	38919
PubChem CID:	8138158
Reduced:	SN4O4C20H24 (1)
Stoich.:	AB4C4D20E24 (1)
Weight, g/mol:	353.99637
ΔH_f, kcal/mol:	-80.43
Dipole, Da:	6.23
IP(EA), eV:	-9.18(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-N-[2-oxo-2-[2-(1H-pyrrole-2-carbonyl)hydrazinyl]ethyl]furan-2-carboxamide

Drug info:

PubChemData

Smile

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)/C=C/C(=O)NNC(=O)C3=CC=CN3

DOS

IR

Vibrations