Geometry & MOs

Info

ID:	290862
PubChem CID:	111366566
Reduced:	IO2N3C18H26 (1)
Stoich.:	AB2C3D18E26 (1)
Weight, g/mol:	503.17572
ΔH_f, kcal/mol:	-43.82
Dipole, Da:	2.9
IP(EA), eV:	-8.87(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[N-[2-(furan-2-yl)ethyl]-N'-(2-methylprop-2-enyl)carbamimidoyl]piperazin-1-yl]-N-propan-2-ylacetamide;hydroiodide

Drug info:

PubChemData

Smile

CCNC(=NCCC1=CC(=CC=C1)O)NC(C)C2=CC=C(O2)C.I

DOS

IR

Vibrations