Geometry & MOs

Info

ID:	361732
PubChem CID:	127304548
Reduced:	O2N5C19H29 (1)
Stoich.:	A2B5C19D29 (1)
Weight, g/mol:	321.205242
ΔH_f, kcal/mol:	-46.37
Dipole, Da:	9.26
IP(EA), eV:	-8.72(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopentyloxy-1-[2-[(3,5-dimethylpyrazol-1-yl)methyl]morpholin-4-yl]ethanone

Drug info:

PubChemData

Smile

CC1=CC(=NN1CC2CN(CCO2)C(=O)C3=NN(C(=C3)C)C(C)(C)C)C

DOS

IR

Vibrations