Geometry & MOs

Info

ID:	369852
PubChem CID:	127336449
Reduced:	S2N3O3C14H23 (1)
Stoich.:	A2B3C3D14E23 (1)
Weight, g/mol:	343.146681
ΔH_f, kcal/mol:	-127.65
Dipole, Da:	9.11
IP(EA), eV:	-9.26(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(SC(=N1)C(C)(C)NC(=O)CCN2CCCS2(=O)=O)C

DOS

IR

Vibrations