Geometry & MOs

Info

ID:	290888
PubChem CID:	111463015
Reduced:	N2O3C18H22 (1)
Stoich.:	A2B3C18D22 (1)
Weight, g/mol:	333.151098
ΔH_f, kcal/mol:	-94.93
Dipole, Da:	5.94
IP(EA), eV:	-9.1(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxy-2,3-dimethylpentyl)-2-(2-pyridin-3-yl-1,3-thiazol-4-yl)acetamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=C(N=CO2)C(=O)N3CCC(CC3)C(C)O

DOS

IR

Vibrations