Geometry & MOs

Info

ID:	247353
PubChem CID:	103070367
Reduced:	N3C15H31 (1)
Stoich.:	A3B15C31 (1)
Weight, g/mol:	226.215747
ΔH_f, kcal/mol:	-14.27
Dipole, Da:	1.35
IP(EA), eV:	-8.12(1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[4-[2-(dimethylamino)ethyl]piperazin-1-yl]methyl]prop-2-en-1-amine

Drug info:

PubChemData

Smile

CCCNCC(=C)CN1CCN(CC1)CC(C)C

DOS

IR

Vibrations