Geometry & MOs

Info

ID:	290671
PubChem CID:	109817050
Reduced:	IO2N5C20H32 (1)
Stoich.:	AB2C5D20E32 (1)
Weight, g/mol:	495.20702
ΔH_f, kcal/mol:	-70.87
Dipole, Da:	6.15
IP(EA), eV:	-8.76(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-2-(3-methyl-2-morpholin-4-ylbutyl)-3-(1-propanoylpyrrolidin-3-yl)guanidine;hydroiodide

Drug info:

PubChemData

Smile

CCC(=O)N1CCC(C1)NC(=NC)NCC2=CC=C(C=C2)NC(=O)C(C)C.I

DOS

IR

Vibrations