Geometry & MOs

Info

ID:	391116
PubChem CID:	135002911
Reduced:	N2O3C23H26 (1)
Stoich.:	A2B3C23D26 (1)
Weight, g/mol:	336.220164
ΔH_f, kcal/mol:	-57.91
Dipole, Da:	1.95
IP(EA), eV:	-8.83(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1S,2R,5R,6R)-3-benzyl-7-(dimethylamino)-2-phenyl-3-azabicyclo[3.2.0]heptan-6-yl]methanol

Drug info:

PubChemData

Smile

C1COCCN1C2=C(N=C(O2)C(CCC3=CC=CC=C3)O)CC4=CC=CC=C4

DOS

IR

Vibrations