Geometry & MOs

Info

ID:	383244
PubChem CID:	134974866
Reduced:	N2O3C19H26 (1)
Stoich.:	A2B3C19D26 (1)
Weight, g/mol:	270.209599
ΔH_f, kcal/mol:	-125.31
Dipole, Da:	2.98
IP(EA), eV:	-9.16(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,2S)-11-benzyl-7,11-diazatricyclo[7.3.1.02,7]tridecane

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1C[C@@H]2CN(CC(C1)C2=O)CC3=CC=CC=C3

DOS

IR

Vibrations