Geometry & MOs

Info

ID:	395
PubChem CID:	2706
Reduced:	N2O3C14H19 (2)
Stoich.:	A2B3C14D19 (2)
Weight, g/mol:	526.279135
ΔH_f, kcal/mol:	-211.15
Dipole, Da:	6.24
IP(EA), eV:	-9.44(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-benzyl-6,6-dimethyl-9-[6-(oxiran-2-yl)-6-oxohexyl]-1,4,7,10-tetrazabicyclo[10.3.0]pentadecane-2,5,8,11-tetrone

Drug info:

PubChemData

Smile

CC1(C(=O)NC(C(=O)N2CCCC2C(=O)NC(C(=O)N1)CCCCCC(=O)C3CO3)CC4=CC=CC=C4)C

DOS

IR

Vibrations