Geometry & MOs

Info

ID:	358881
PubChem CID:	127296752
Reduced:	O2N5C21H39 (1)
Stoich.:	A2B5C21D39 (1)
Weight, g/mol:	397.247775
ΔH_f, kcal/mol:	-124.79
Dipole, Da:	5.64
IP(EA), eV:	-8.67(1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1H-indol-2-yl)-N-[3-(4-methylpiperazin-1-yl)-3-oxopropyl]piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC(C)C(=O)N1CCC(CC1)NC(=O)N2CCN(CC2)CC3CCCCN3C

DOS

IR

Vibrations