Geometry & MOs

Info

ID:	64840
PubChem CID:	29204077
Reduced:	N2O3C19H22 (1)
Stoich.:	A2B3C19D22 (1)
Weight, g/mol:	256.157563
ΔH_f, kcal/mol:	-93.14
Dipole, Da:	5.2
IP(EA), eV:	-9.62(-1.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3R,5R)-3,5-dimethylpiperidin-1-yl]-(1H-indol-2-yl)methanone

Drug info:

PubChemData

Smile

C[C@@H]1C[C@@H](CN(C1)C(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC=C)C

DOS

IR

Vibrations