Geometry & MOs

Info

ID:	291342
PubChem CID:	111978699
Reduced:	IO2N4C23H39 (1)
Stoich.:	AB2C4D23E39 (1)
Weight, g/mol:	402.299476
ΔH_f, kcal/mol:	-79.92
Dipole, Da:	2.15
IP(EA), eV:	-8.74(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-1-(4-ethoxybutyl)-3-ethylguanidine

Drug info:

PubChemData

Smile

CCNC(=NCC(=O)N1CCC(CC1)CC2=CC=CC=C2)NCCCCOCC.I

DOS

IR

Vibrations