Geometry & MOs

Info

ID:	417708
PubChem CID:	135102531
Reduced:	ON8C19H26 (1)
Stoich.:	AB8C19D26 (1)
Weight, g/mol:	315.169525
ΔH_f, kcal/mol:	77.73
Dipole, Da:	7.38
IP(EA), eV:	-9.23(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[6-[1-(1-methylpyrazol-4-yl)ethylamino]pyridin-3-yl]-morpholin-4-ylmethanone

Drug info:

PubChemData

Smile

CC1=C(N=CN1)CN(CCN(C)C)C(=O)C(CC2=CC=CC=C2)N3C=NN=N3

DOS

IR

Vibrations