Geometry & MOs

Info

ID:	344508
PubChem CID:	127268092
Reduced:	ON2C11H15 (2)
Stoich.:	AB2C11D15 (2)
Weight, g/mol:	396.252526
ΔH_f, kcal/mol:	-68.54
Dipole, Da:	3.44
IP(EA), eV:	-8.81(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(1H-indole-2-carbonyl)piperazin-1-yl]-N-(2-methylcyclohexyl)propanamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1CCCCC1)N2CCN(CC2)C(=O)C3=CC4=CC=CC=C4N3

DOS

IR

Vibrations