Geometry & MOs

Info

ID:	430747
PubChem CID:	135170814
Reduced:	ON5C21H27 (1)
Stoich.:	AB5C21D27 (1)
Weight, g/mol:	365.221561
ΔH_f, kcal/mol:	18.4
Dipole, Da:	7.72
IP(EA), eV:	-8.84(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-N-[3-(1H-imidazol-5-ylmethylamino)cyclohexyl]-1H-indole-2-carboxamide

Drug info:

PubChemData

Smile

CCN([C@H]1CCC[C@H](C1)NCC2=CN=CN2)C(=O)C3=CC4=CC=CC=C4N3

DOS

IR

Vibrations