Geometry & MOs

Info

ID:	290914
PubChem CID:	111639334
Reduced:	FN4C21H33 (1)
Stoich.:	AB4C21D33 (1)
Weight, g/mol:	335.237291
ΔH_f, kcal/mol:	-12.59
Dipole, Da:	1.45
IP(EA), eV:	-8.56(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[1-(3-fluorophenyl)cyclopropyl]methyl]-2-methyl-3-[3-(2-methylpropoxy)propyl]guanidine

Drug info:

PubChemData

Smile

CCCN1CCC(CC1)CNC(=NC)NCC2(CC2)C3=CC(=CC=C3)F

DOS

IR

Vibrations