Geometry & MOs

Info

ID:	209597
PubChem CID:	80692544
Reduced:	NO2C14H19 (1)
Stoich.:	AB2C14D19 (1)
Weight, g/mol:	271.054611
ΔH_f, kcal/mol:	-69.8
Dipole, Da:	3.01
IP(EA), eV:	-7.8(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-chloro-2-(4-ethyl-3,5-dimethylpyrazol-1-yl)-1,3-thiazol-5-yl]methanol

Drug info:

PubChemData

Smile

CC1(CCC(C1)NC2=CC3=C(C=C2)OCO3)C

DOS

IR

Vibrations