Geometry & MOs

Info

ID:	435347
PubChem CID:	135191258
Reduced:	N3C8H15 (1)
Stoich.:	A3B8C15 (1)
Weight, g/mol:	269.139134
ΔH_f, kcal/mol:	45.56
Dipole, Da:	3.52
IP(EA), eV:	-8.87(0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3aR,6aS)-2-methyl-5-[2-(trifluoromethyl)phenyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole

Drug info:

PubChemData

Smile

CCN1CC2C(C1)NN=C2C

DOS

IR

Vibrations