Geometry & MOs

Info

ID:	290878
PubChem CID:	111391099
Reduced:	O2N3C21H35 (1)
Stoich.:	A2B3C21D35 (1)
Weight, g/mol:	279.211076
ΔH_f, kcal/mol:	-46.58
Dipole, Da:	4.4
IP(EA), eV:	-8.74(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(3-fluorophenyl)ethyl]-2-methyl-3-(4-methylpentyl)guanidine

Drug info:

PubChemData

Smile

CN=C(NCCCCOCCC1=CC=CC=C1)NCCCOCC2CC2

DOS

IR

Vibrations