Geometry & MOs

Info

ID:	187297
PubChem CID:	77556407
Reduced:	O4N5C29H47 (1)
Stoich.:	A4B5C29D47 (1)
Weight, g/mol:	192.101111
ΔH_f, kcal/mol:	-204.15
Dipole, Da:	2.89
IP(EA), eV:	-8.69(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(2-methylpyrimidin-4-yl)-1,3-diazinan-4-one

Drug info:

PubChemData

Smile

CC(C)CCN1CCN(C(C1)OC(=O)NC2CCCC3=CC=CC=C23)C(=O)C(C(C)C)NC(=O)C(C)NC

DOS

IR

Vibrations