Geometry & MOs

Info

ID:	430950
PubChem CID:	135171020
Reduced:	ON4C25H32 (1)
Stoich.:	AB4C25D32 (1)
Weight, g/mol:	353.246713
ΔH_f, kcal/mol:	-3.74
Dipole, Da:	6.76
IP(EA), eV:	-8.29(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1S,3R)-3-(2-cyclopropylethylamino)cyclohexyl]-N-ethyl-1H-indole-2-carboxamide

Drug info:

PubChemData

Smile

CCN([C@H]1CCC[C@H](C1)NCC2=CC(=C(C=C2)N)C)C(=O)C3=CC4=CC=CC=C4N3

DOS

IR

Vibrations