Geometry & MOs

Info

ID:	430882
PubChem CID:	135170949
Reduced:	FON4C25H37 (1)
Stoich.:	ABC4D25E37 (1)
Weight, g/mol:	376.226312
ΔH_f, kcal/mol:	-56.82
Dipole, Da:	1.22
IP(EA), eV:	-8.87(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCN(C1CCCC(C1)NC/C(=C/C)/C=C\C(=C)C)C(=O)C2=NC(=C(N2)C)/C=C(\C)/F

DOS

IR

Vibrations