Geometry & MOs

Info

ID:	361463
PubChem CID:	127303551
Reduced:	O2N7C13H19 (1)
Stoich.:	A2B7C13D19 (1)
Weight, g/mol:	387.172896
ΔH_f, kcal/mol:	36.44
Dipole, Da:	3.13
IP(EA), eV:	-9.59(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-[2-(6,7-dihydro-5H-pyrazolo[1,5-a]pyrimidin-4-yl)-2-oxoethyl]cyclohexyl]-N-(1,3-thiazol-2-yl)acetamide

Drug info:

PubChemData

Smile

CC1=NOC(=N1)CN2CCN(CC2)C(=O)CCN3C=CN=N3

DOS

IR

Vibrations