Geometry & MOs

Info

ID:	147783
PubChem CID:	53787441
Reduced:	C18H29 (2)
Stoich.:	A18B29 (2)
Weight, g/mol:	428.20124
ΔH_f, kcal/mol:	-5.92
Dipole, Da:	0.58
IP(EA), eV:	-8.62(0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[3-[1-(3-fluoro-4-phenylphenyl)ethyl]-1,2-oxazol-5-yl]methyl]-1-(4-methylphenyl)guanidine

Drug info:

PubChemData

Smile

CCCCCCC.CCC=CCC.CCC#CCC.CC1=CC=C(C=C1)C(C)(C)C2=CC=C(C=C2)C

DOS

IR

Vibrations