Geometry & MOs

Info

ID:	354073
PubChem CID:	127285872
Reduced:	O2N5C18H21 (1)
Stoich.:	A2B5C18D21 (1)
Weight, g/mol:	348.161997
ΔH_f, kcal/mol:	24.93
Dipole, Da:	6.06
IP(EA), eV:	-9.07(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-(cyclohexylmethyl)-1H-pyrazol-3-yl]-2-(4,5-dimethyl-2-oxo-1,3-thiazol-3-yl)acetamide

Drug info:

PubChemData

Smile

CC1=NOC2=C1C=C(C=N2)C(=O)NC3=NNC(=C3)CC4CCCCC4

DOS

IR

Vibrations