Geometry & MOs

Info

ID:	258952
PubChem CID:	103157530
Reduced:	NOSC16H27 (1)
Stoich.:	ABCD16E27 (1)
Weight, g/mol:	281.093104
ΔH_f, kcal/mol:	-58.28
Dipole, Da:	1.87
IP(EA), eV:	-9.01(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-[(4-chlorophenyl)methyl]-1,2,4-oxadiazol-5-yl]-2-methoxypropan-1-amine

Drug info:

PubChemData

Smile

CC(C)C(C1=CC=CS1)NCC(CC2CCCC2)O

DOS

IR

Vibrations