Geometry & MOs

Info

ID:	294999
PubChem CID:	117511323
Reduced:	BrNO3C14H20 (1)
Stoich.:	ABC3D14E20 (1)
Weight, g/mol:	329.06266
ΔH_f, kcal/mol:	-105.84
Dipole, Da:	4.07
IP(EA), eV:	-8.58(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-bromo-2-ethyl-4,5-dimethoxyphenyl)morpholine

Drug info:

PubChemData

Smile

CC(C)OC1=C(C=C(C=C1OC)Br)C2CNCCO2

DOS

IR

Vibrations