Geometry & MOs

Info

ID:	290667
PubChem CID:	109817028
Reduced:	ION4C22H35 (1)
Stoich.:	ABC4D22E35 (1)
Weight, g/mol:	522.14917
ΔH_f, kcal/mol:	-34.75
Dipole, Da:	3.45
IP(EA), eV:	-9.12(0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-1-[[2-(phenoxymethyl)phenyl]methyl]-3-(1-propanoylpyrrolidin-3-yl)guanidine;hydroiodide

Drug info:

PubChemData

Smile

CCC(=O)N1CCC(C1)NC(=NCC2(CCCC2)C3=CC=CC=C3)NCC.I

DOS

IR

Vibrations