Geometry & MOs

Info

ID:	360915
PubChem CID:	127301621
Reduced:	O2N4C23H30 (1)
Stoich.:	A2B4C23D30 (1)
Weight, g/mol:	367.200825
ΔH_f, kcal/mol:	-20.77
Dipole, Da:	6.18
IP(EA), eV:	-8.42(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-adamantyl)-N-[2-oxo-2-(pyrazolo[1,5-a]pyrimidin-7-ylamino)ethyl]acetamide

Drug info:

PubChemData

Smile

COC1=CC2=C(C=C1)C(CCC2)CC(=O)N3CCC(CC3)C4=NN=CN4C5CC5

DOS

IR

Vibrations