Geometry & MOs

Info

ID:	235269
PubChem CID:	92304314
Reduced:	FON2C27H27 (1)
Stoich.:	ABC2D27E27 (1)
Weight, g/mol:	386.220557
ΔH_f, kcal/mol:	-24.85
Dipole, Da:	6.81
IP(EA), eV:	-8.28(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (3S)-1-(4-ethoxy-1-propylindole-2-carbonyl)piperidine-3-carboxylate

Drug info:

PubChemData

Smile

CCN1C=C(C2=CC=CC=C21)[C@H](CC(=O)N[C@H](C)C3=CC=CC=C3)C4=CC(=CC=C4)F

DOS

IR

Vibrations