Geometry & MOs

Info

ID:	333145
PubChem CID:	127251693
Reduced:	O3N5C24H35 (1)
Stoich.:	A3B5C24D35 (1)
Weight, g/mol:	436.258674
ΔH_f, kcal/mol:	-77.99
Dipole, Da:	4.13
IP(EA), eV:	-8.6(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclopentyl-1-[2-[2-methyl-3-[(2-methylimidazol-1-yl)methyl]pyrazolo[1,5-a]pyrimidin-7-yl]morpholin-4-yl]propan-1-one

Drug info:

PubChemData

Smile

CC1=NN2C(=CC=NC2=C1CN3CCOCC3)C4CN(CCO4)C(=O)CCC5CCCC5

DOS

IR

Vibrations