Geometry & MOs

Info

ID:	362063
PubChem CID:	127305600
Reduced:	SN2O2C17H26 (1)
Stoich.:	AB2C2D17E26 (1)
Weight, g/mol:	383.177982
ΔH_f, kcal/mol:	-94.37
Dipole, Da:	3.64
IP(EA), eV:	-9.04(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4-cyclohexyl-1,3-thiazol-2-yl)ethyl]-2,7-dimethylpyrazolo[1,5-a]pyrimidine-6-carboxamide

Drug info:

PubChemData

Smile

C1CCC(CC1)C2=CSC(=N2)CCNC(=O)C3CCCOC3

DOS

IR

Vibrations