Geometry & MOs

Info

ID:	139921
PubChem CID:	52617931
Reduced:	NO6C18H19 (1)
Stoich.:	AB6C18D19 (1)
Weight, g/mol:	387.02702
ΔH_f, kcal/mol:	-111.74
Dipole, Da:	7.59
IP(EA), eV:	-8.9(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(6-bromonaphthalen-2-yl)oxy-N-[(3-fluorophenyl)methyl]acetamide

Drug info:

PubChemData

Smile

CCOC1=C(C=CC(=C1)C=O)OCCCOC2=CC=C(C=C2)[N+](=O)[O-]

DOS

IR

Vibrations