Geometry & MOs

Info

ID:	176472
PubChem CID:	76054447
Reduced:	O2N5C15H23 (1)
Stoich.:	A2B5C15D23 (1)
Weight, g/mol:	279.169525
ΔH_f, kcal/mol:	-44.91
Dipole, Da:	5.58
IP(EA), eV:	-9.26(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3-dimethyl-6-[[2-(4-methylpyrazol-1-yl)ethylamino]methyl]-1,3-diazinane-2,4-dione

Drug info:

PubChemData

Smile

CC1=CC(=NN1C2CN(C2)CC3CC(=O)N(C(=O)N3C)C)C

DOS

IR

Vibrations