Geometry & MOs

Info

ID:	171478
PubChem CID:	75382821
Reduced:	FON2C20H25 (1)
Stoich.:	ABC2D20E25 (1)
Weight, g/mol:	329.00112
ΔH_f, kcal/mol:	-47.46
Dipole, Da:	2.4
IP(EA), eV:	-8.76(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(5-bromo-2-nitrophenyl)morpholine-2-carboxamide

Drug info:

PubChemData

Smile

CC(C1=CC=CC=C1F)NCC2=CC(=CC=C2)CN3CCOCC3

DOS

IR

Vibrations