Geometry & MOs

Info

ID:	340610
PubChem CID:	127262621
Reduced:	N4O11C20H30 (1)
Stoich.:	A4B11C20D30 (1)
Weight, g/mol:	330.162954
ΔH_f, kcal/mol:	-487.3
Dipole, Da:	9.67
IP(EA), eV:	-9.94(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-benzyl-9-methyl-3,9-diazaspiro[5.5]undecane;dihydrochloride

Drug info:

PubChemData

Smile

CC(C)[C@@H](C(=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)N)N([C@@H](CC(=O)O)C=O)C(=O)C

DOS

IR

Vibrations