Geometry & MOs

Info

ID:	380502
PubChem CID:	134970966
Reduced:	NO3C11H17 (1)
Stoich.:	AB3C11D17 (1)
Weight, g/mol:	344.200097
ΔH_f, kcal/mol:	-105.19
Dipole, Da:	0.57
IP(EA), eV:	-9.46(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(2S,5S)-5-(1H-indol-3-yl)-1,4-dimethylpiperazin-2-yl]-1H-indole

Drug info:

PubChemData

Smile

C[C@H]([C@@H](C(=O)OC)NCC1C=CC=C1)O

DOS

IR

Vibrations