Geometry & MOs

Info

ID:	177719
PubChem CID:	76220930
Reduced:	ON2C10H12 (1)
Stoich.:	AB2C10D12 (1)
Weight, g/mol:	193.157898
ΔH_f, kcal/mol:	2.9
Dipole, Da:	3.14
IP(EA), eV:	-9.96(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1,2,5-trimethylpyrrol-3-yl)piperazine

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)C(CCO)N)C#N

DOS

IR

Vibrations