Geometry & MOs

Info

ID:	244570
PubChem CID:	99365008
Reduced:	SO3N4C20H22 (1)
Stoich.:	AB3C4D20E22 (1)
Weight, g/mol:	452.134068
ΔH_f, kcal/mol:	-38.43
Dipole, Da:	5.12
IP(EA), eV:	-8.45(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-2-phenyl-N'-[4-(thiomorpholin-4-ylmethyl)benzoyl]-1,3-thiazole-5-carbohydrazide

Drug info:

PubChemData

Smile

CC[C@@H](C1=C(ON=C1C)C)C(=O)NC2=NC(=CS2)C3=CC=C(C=C3)NC(=O)C

DOS

IR

Vibrations