Geometry & MOs

Info

ID:	361710
PubChem CID:	127304525
Reduced:	SO2N6C17H26 (1)
Stoich.:	AB2C6D17E26 (1)
Weight, g/mol:	383.19574
ΔH_f, kcal/mol:	-22.75
Dipole, Da:	4.35
IP(EA), eV:	-8.94(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[(3,5-dimethylpyrazol-1-yl)methyl]morpholin-4-yl]-(3-propan-2-yl-[1,2]oxazolo[5,4-b]pyridin-5-yl)methanone

Drug info:

PubChemData

Smile

CC1=CC(=NN1CC2CN(CCO2)C(=O)CSC3=NN=CN3C(C)C)C

DOS

IR

Vibrations