Geometry & MOs

Info

ID:	281885
PubChem CID:	103914496
Reduced:	ON2C17H34 (1)
Stoich.:	AB2C17D34 (1)
Weight, g/mol:	247.132077
ΔH_f, kcal/mol:	-97.36
Dipole, Da:	3.09
IP(EA), eV:	-8.64(2.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-[(5-methyl-1,2,4-oxadiazol-3-yl)methylamino]propyl]phenol

Drug info:

PubChemData

Smile

CC(C)CN1CCC(CC1)NCC2(CCCCC2)CO

DOS

IR

Vibrations