Geometry & MOs

Info

ID:	291651
PubChem CID:	113455979
Reduced:	BrN2C14H23 (1)
Stoich.:	AB2C14D23 (1)
Weight, g/mol:	311.09971
ΔH_f, kcal/mol:	-2.86
Dipole, Da:	3.56
IP(EA), eV:	-8.76(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(5-bromopyridin-3-yl)methyl]-2,2-diethylpiperazine

Drug info:

PubChemData

Smile

CCCNC(C)CC(C)CC1=NC=C(C=C1)Br

DOS

IR

Vibrations