Geometry & MOs

Info

ID:	158625
PubChem CID:	56464336
Reduced:	S2N4O4C23H26 (1)
Stoich.:	A2B4C4D23E26 (1)
Weight, g/mol:	400.98673
ΔH_f, kcal/mol:	-81.22
Dipole, Da:	4.62
IP(EA), eV:	-9.55(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(5-bromothiophene-2-carbonyl)-4-methyl-2-(2-methylpropyl)-1,3-thiazole-5-carbohydrazide

Drug info:

PubChemData

Smile

CC1=C(SC(=N1)CC(C)C)C(=O)NNC(=O)C2=CC(=CC=C2)S(=O)(=O)NCC3=CC=CC=C3

DOS

IR

Vibrations