Geometry & MOs

Info

ID:	64989
PubChem CID:	29204302
Reduced:	Cl3O3N4C21H27 (1)
Stoich.:	A3B3C4D21E27 (1)
Weight, g/mol:	433.977395
ΔH_f, kcal/mol:	-140.0
Dipole, Da:	6.22
IP(EA), eV:	-9.02(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[4-oxo-4-[2-(2,4,6-trichlorophenyl)hydrazinyl]butanoyl]amino]thiophene-3-carboxamide

Drug info:

PubChemData

Smile

CCC(C)(C)C1CCC2(CC1)C(=O)N(C(=O)N2)CC(=O)NNC3=C(C=C(C=C3Cl)Cl)Cl

DOS

IR

Vibrations