Geometry & MOs

Info

ID:	179133
PubChem CID:	76440575
Reduced:	ON7C15H21 (1)
Stoich.:	AB7C15D21 (1)
Weight, g/mol:	334.24811
ΔH_f, kcal/mol:	68.42
Dipole, Da:	3.28
IP(EA), eV:	-9.39(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[2-(1-ethylpiperidin-3-yl)imidazol-1-yl]ethylamino]-6-methyl-1,3-diazinan-4-one

Drug info:

PubChemData

Smile

C1C(NNN1)C(=O)N(CCCN2C=CN=C2)CC3=CC=NC=C3

DOS

IR

Vibrations