Geometry & MOs

Info

ID:	281274
PubChem CID:	103913635
Reduced:	NOC17H29 (1)
Stoich.:	ABC17D29 (1)
Weight, g/mol:	273.184112
ΔH_f, kcal/mol:	-64.86
Dipole, Da:	1.89
IP(EA), eV:	-8.99(0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-1-phenylhexan-1-amine

Drug info:

PubChemData

Smile

CCCCCC(C1=CC=CC=C1)NCCCCCO

DOS

IR

Vibrations