Geometry & MOs

Info

ID:	74829
PubChem CID:	48422550
Reduced:	NO2C6H8 (2)
Stoich.:	AB2C6D8 (2)
Weight, g/mol:	355.07831
ΔH_f, kcal/mol:	-97.84
Dipole, Da:	1.17
IP(EA), eV:	-9.14(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-bromo-2-methoxyphenyl)methyl]-2-(cyclopropylmethoxy)-N-methylpropanamide

Drug info:

PubChemData

Smile

CC(C(=O)NNC(=O)C1=CC=CO1)OCC2CC2

DOS

IR

Vibrations