Geometry & MOs

Info

ID:	430726
PubChem CID:	135170793
Reduced:	ON4C24H30 (1)
Stoich.:	AB4C24D30 (1)
Weight, g/mol:	391.205991
ΔH_f, kcal/mol:	15.37
Dipole, Da:	3.27
IP(EA), eV:	-8.93(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-N-[3-[(3-fluorophenyl)methylamino]cyclohex-3-en-1-yl]-1H-indole-2-carboxamide

Drug info:

PubChemData

Smile

CCN([C@H]1CCC[C@H](C1)N[C@H](C)C2=CC=CC=C2)C(=O)C3=CC4=C(N3)C=CC=N4

DOS

IR

Vibrations