Geometry & MOs

Info

ID:	126481
PubChem CID:	50966294
Reduced:	NO2C18H23 (1)
Stoich.:	AB2C18D23 (1)
Weight, g/mol:	348.206245
ΔH_f, kcal/mol:	-43.78
Dipole, Da:	2.03
IP(EA), eV:	-8.68(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,5-dimethyl-3-[4-[(1-pyridin-3-ylpyrrol-2-yl)methyl]piperazin-1-yl]pyrazine

Drug info:

PubChemData

Smile

CC(C1=CC=CC(=C1)C2=CC(=CC(=C2)OC)OC)N(C)C

DOS

IR

Vibrations