Geometry & MOs

Info

ID:	267319
PubChem CID:	103581781
Reduced:	BrClNOC14H19 (1)
Stoich.:	ABCDE14F19 (1)
Weight, g/mol:	227.163377
ΔH_f, kcal/mol:	-40.43
Dipole, Da:	2.61
IP(EA), eV:	-9.36(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methoxy-4-methyl-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]pentan-2-amine

Drug info:

PubChemData

Smile

CC1(CCOCC1)CNCC2=CC(=C(C=C2)Br)Cl

DOS

IR

Vibrations