Geometry & MOs

Info

ID:	290889
PubChem CID:	111463601
Reduced:	SO2N3C17H23 (1)
Stoich.:	AB2C3D17E23 (1)
Weight, g/mol:	320.130697
ΔH_f, kcal/mol:	-55.42
Dipole, Da:	4.18
IP(EA), eV:	-9.29(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxy-2,3-dimethylbutyl)-2-(2-pyrazin-2-yl-1,3-thiazol-4-yl)acetamide

Drug info:

PubChemData

Smile

CCC(C)C(C)(CNC(=O)CC1=CSC(=N1)C2=CN=CC=C2)O

DOS

IR

Vibrations