Geometry & MOs

Info

ID:	360175
PubChem CID:	127300816
Reduced:	ON5C23H27 (1)
Stoich.:	AB5C23D27 (1)
Weight, g/mol:	358.175339
ΔH_f, kcal/mol:	33.47
Dipole, Da:	5.07
IP(EA), eV:	-9.01(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[4-[methyl-(6-methylpyridazin-3-yl)amino]piperidin-1-yl]-2-oxoethyl]pyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CC1=CC2=CC(=C(N=C2C=C1)C)C(=O)N3CCC(CC3)N(C)C4=NN=C(C=C4)C

DOS

IR

Vibrations