Geometry & MOs

Info

ID:	368393
PubChem CID:	127328301
Reduced:	O2N3C22H37 (1)
Stoich.:	A2B3C22D37 (1)
Weight, g/mol:	396.252526
ΔH_f, kcal/mol:	-137.66
Dipole, Da:	1.45
IP(EA), eV:	-8.75(0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclohexyl-2-[4-(4,5-dimethyl-1H-indole-2-carbonyl)piperazin-1-yl]acetamide

Drug info:

PubChemData

Smile

CCN1CCC(CC1)N(C)C(=O)CNC(=O)CC23CC4CC(C2)CC(C4)C3

DOS

IR

Vibrations