Geometry & MOs

Info

ID:	56905
PubChem CID:	22394824
Reduced:	S2N5O5C17H21 (1)
Stoich.:	A2B5C5D17E21 (1)
Weight, g/mol:	429.102828
ΔH_f, kcal/mol:	-128.16
Dipole, Da:	8.13
IP(EA), eV:	-9.91(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,4-dihydroxy-5-methoxy-1-phenylpentan-2-yl)-2-(methanesulfonamido)-1,3-thiazole-4-carboxamide

Drug info:

PubChemData

Smile

CN(C1=NC(=CS1)C(=O)NC(CC2=CC=NC=C2)C(C(CC#N)O)O)S(=O)(=O)C

DOS

IR

Vibrations