Geometry & MOs

Info

ID:	344505
PubChem CID:	127268089
Reduced:	ON2C11H15 (2)
Stoich.:	AB2C11D15 (2)
Weight, g/mol:	396.252526
ΔH_f, kcal/mol:	-58.32
Dipole, Da:	3.16
IP(EA), eV:	-8.76(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclohexyl-N-ethyl-2-[4-(1H-indole-2-carbonyl)piperazin-1-yl]acetamide

Drug info:

PubChemData

Smile

CN(C1CCCCC1)C(=O)CN2CCN(CC2)C(=O)C3=CC4=CC=CC=C4N3

DOS

IR

Vibrations