Geometry & MOs

Info

ID:	291036
PubChem CID:	111677811
Reduced:	FION4C20H32 (1)
Stoich.:	ABCD4E20F32 (1)
Weight, g/mol:	362.24819
ΔH_f, kcal/mol:	-50.87
Dipole, Da:	3.78
IP(EA), eV:	-8.93(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1-cyclopropylpyrrolidin-3-yl)methyl]-3-ethyl-2-[2-(4-fluorophenoxy)propyl]guanidine

Drug info:

PubChemData

Smile

CCNC(=NCC(C)OC1=CC=C(C=C1)F)NCC2CCN(C2)C3CC3.I

DOS

IR

Vibrations