Geometry & MOs

Info

ID:	290915
PubChem CID:	111639498
Reduced:	FON3C19H30 (1)
Stoich.:	ABC3D19E30 (1)
Weight, g/mol:	516.17614
ΔH_f, kcal/mol:	-54.97
Dipole, Da:	5.31
IP(EA), eV:	-9.09(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-2-[[1-(3-fluorophenyl)cyclopropyl]methyl]-3-[3-(3-methylpiperidin-1-yl)-3-oxopropyl]guanidine;hydroiodide

Drug info:

PubChemData

Smile

CC(C)COCCCNC(=NC)NCC1(CC1)C2=CC(=CC=C2)F

DOS

IR

Vibrations