Geometry & MOs

Info

ID:	189401
PubChem CID:	77849826
Reduced:	N2O3C14H18 (1)
Stoich.:	A2B3C14D18 (1)
Weight, g/mol:	356.196074
ΔH_f, kcal/mol:	-94.06
Dipole, Da:	3.37
IP(EA), eV:	-8.88(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-6-[1-(2-methylimidazo[1,2-a]pyrimidine-3-carbonyl)piperidin-3-yl]-1,3-diazinan-4-one

Drug info:

PubChemData

Smile

CCC1(CCN(CC1O)C2=NC=CC3=C2C=CO3)O

DOS

IR

Vibrations