Geometry & MOs

Info

ID:	331639
PubChem CID:	127249722
Reduced:	OSN5C18H27 (1)
Stoich.:	ABC5D18E27 (1)
Weight, g/mol:	383.232125
ΔH_f, kcal/mol:	14.62
Dipole, Da:	4.24
IP(EA), eV:	-8.75(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cyclohexyl-[2-[6-[(1,5-dimethylpyrazol-3-yl)amino]pyridin-2-yl]morpholin-4-yl]methanone

Drug info:

PubChemData

Smile

CCC1=NN=C(S1)NC2=CC=CC(=N2)C3CN(CCO3)CC(C)(C)C

DOS

IR

Vibrations