Geometry & MOs

Info

ID:	56929
PubChem CID:	22394903
Reduced:	S2N4O6C19H24 (1)
Stoich.:	A2B4C6D19E24 (1)
Weight, g/mol:	473.111285
ΔH_f, kcal/mol:	-191.16
Dipole, Da:	8.0
IP(EA), eV:	-9.12(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,4-dihydroxy-7-methylsulfanyl-1-phenylheptan-2-yl)-2-(methanesulfonamido)-1,3-thiazole-4-carboxamide

Drug info:

PubChemData

Smile

CS(=O)(=O)NC1=NC(=CS1)C(=O)NC(CC2=CC=C(C=C2)O)C(C(CCCC#N)O)O

DOS

IR

Vibrations