Geometry & MOs

Info

ID:

76090

PubChem CID:

48424413

Reduced:

BrN2O3C16H21 (1)

Stoich.:

AB2C3D16E21 (1)

Weight, g/mol:

277.167794

ΔHf, kcal/mol:

-106.64

Dipole, Da:

9.36

IP(EA), eV:

-8.66(-0.04)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-(cyclopropylmethoxy)-N-[2-(2-methylphenoxy)ethyl]propanamide

Drug info:

PubChemData

Smile

CC(C(=O)NCCC(=O)NC1=CC=C(C=C1)Br)OCC2CC2

DOS

IR

Vibrations