Geometry & MOs

Info

ID:	423764
PubChem CID:	135120171
Reduced:	NOC4H5 (4)
Stoich.:	ABC4D5 (4)
Weight, g/mol:	326.199428
ΔH_f, kcal/mol:	-104.5
Dipole, Da:	5.89
IP(EA), eV:	-8.58(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-1-spiro[4,9-dihydro-3H-pyrano[3,4-b]indole-1,4'-piperidine]-1'-ylbutan-1-one

Drug info:

PubChemData

Smile

CC1=CC(=NN1)C[C@@H]2CN(C[C@H]2O)C(=O)C3=CC(=O)C(=CN3)OC

DOS

IR

Vibrations