Geometry & MOs

Info

ID:	333151
PubChem CID:	127251699
Reduced:	O3N5C24H35 (1)
Stoich.:	A3B5C24D35 (1)
Weight, g/mol:	422.243024
ΔH_f, kcal/mol:	-91.6
Dipole, Da:	5.9
IP(EA), eV:	-8.71(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=NN2C(=CC=NC2=C1CN3CCC(CC3)O)C4CN(CCO4)C(=O)CC5CCCC5

DOS

IR

Vibrations