Geometry & MOs

Info

ID:	290708
PubChem CID:	109817199
Reduced:	ON5C20H29 (1)
Stoich.:	AB5C20D29 (1)
Weight, g/mol:	483.14951
ΔH_f, kcal/mol:	7.96
Dipole, Da:	2.65
IP(EA), eV:	-8.13(0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[4-(2,5-dihydropyrrol-1-yl)phenyl]methyl]-2-methyl-3-(1-propanoylpyrrolidin-3-yl)guanidine;hydroiodide

Drug info:

PubChemData

Smile

CCC(=O)N1CCC(C1)NC(=NC)NCC2=CC(=CC=C2)N3CC=CC3

DOS

IR

Vibrations