Geometry & MOs

Info

ID:	304392
PubChem CID:	124576988
Reduced:	ON4C19H26 (1)
Stoich.:	AB4C19D26 (1)
Weight, g/mol:	281.06266
ΔH_f, kcal/mol:	8.43
Dipole, Da:	5.68
IP(EA), eV:	-8.64(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[(2R)-2-bromo-3-methoxypropyl]-N-methylcarbamate

Drug info:

PubChemData

Smile

C[C@H](CCC1=CC=C(C=C1)O)N[C@@H]2CCCN(C2)C3=NN=CC=C3

DOS

IR

Vibrations