Geometry & MOs

Info

ID:	430858
PubChem CID:	135170925
Reduced:	O2N5C21H27 (1)
Stoich.:	A2B5C21D27 (1)
Weight, g/mol:	381.216475
ΔH_f, kcal/mol:	-12.28
Dipole, Da:	1.53
IP(EA), eV:	-8.79(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-N-[3-[(5-methyl-1,3,4-oxadiazol-2-yl)methylamino]cyclohexyl]-1H-indole-2-carboxamide

Drug info:

PubChemData

Smile

CCN([C@H]1CCC[C@H](C1)NCC2=NN=C(O2)C)C(=O)C3=CC4=CC=CC=C4N3

DOS

IR

Vibrations