Geometry & MOs

Info

ID:	305408
PubChem CID:	124807152
Reduced:	ON4C20H32 (1)
Stoich.:	AB4C20D32 (1)
Weight, g/mol:	336.140868
ΔH_f, kcal/mol:	-22.44
Dipole, Da:	4.68
IP(EA), eV:	-8.26(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[(1R,8R)-5-methyl-3-phenyl-4,5,10-triazatricyclo[6.3.0.02,6]undeca-2(6),3-dien-10-yl]methyl]-1,3-thiazole

Drug info:

PubChemData

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CN1CCN(CC1)C[C@@H]2CCC[C@]3(O2)CCN(C3)CC4=CC=NC=C4

DOS

IR

Vibrations