Geometry & MOs

Info

ID:	216609
PubChem CID:	85086494
Reduced:	O2N3C16H19 (1)
Stoich.:	A2B3C16D19 (1)
Weight, g/mol:	285.147727
ΔH_f, kcal/mol:	5.68
Dipole, Da:	4.32
IP(EA), eV:	-9.14(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-benzyl-2,3,4,7-tetramethyl-1,5,7-triazatricyclo[3.3.0.02,4]octane-6,8-dione

Drug info:

PubChemData

Smile

C1CNCCC1CCC2=NOC3=C2C=CC4=NC(=O)CC43

DOS

IR

Vibrations