Geometry & MOs

Info

ID:	290629
PubChem CID:	109779709
Reduced:	ION5C23H36 (1)
Stoich.:	ABC5D23E36 (1)
Weight, g/mol:	315.234434
ΔH_f, kcal/mol:	3.49
Dipole, Da:	6.45
IP(EA), eV:	-9.03(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[1-(2-ethoxyethyl)cyclopentyl]methyl]-1-ethyl-3-(2-methylsulfanylethyl)guanidine

Drug info:

PubChemData

Smile

CCOCCC1(CCCC1)CNC(=NC)NCC2=NC=CN2CC3=CC=CC=C3.I

DOS

IR

Vibrations