Geometry & MOs

Info

ID:	120928
PubChem CID:	50750876
Reduced:	O2N5H27C29 (1)
Stoich.:	A2B5C27D29 (1)
Weight, g/mol:	362.210661
ΔH_f, kcal/mol:	30.9
Dipole, Da:	6.21
IP(EA), eV:	-7.94(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-methyl-3-[piperidin-1-yl(pyridin-2-yl)methyl]-1H-indol-5-yl]acetamide

Drug info:

PubChemData

Smile

CC1=NC(=CC=C1)NC(C2=CC=CC=N2)C3=C(NC4=C3C=C(C=C4)NC(=O)C5=CC=CC=C5OC)C

DOS

IR

Vibrations