Geometry & MOs

Info

ID:	361124
PubChem CID:	127302040
Reduced:	O2N4C17H32 (1)
Stoich.:	A2B4C17D32 (1)
Weight, g/mol:	314.210661
ΔH_f, kcal/mol:	-119.78
Dipole, Da:	2.63
IP(EA), eV:	-8.23(0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1,4-dimethylpiperazin-2-yl)methyl]-2,3-dimethyl-1H-indole-5-carboxamide

Drug info:

PubChemData

Smile

CN1CCN(C(C1)CNC(=O)CNC(=O)CC2CCCCC2)C

DOS

IR

Vibrations