Geometry & MOs

Info

ID:	285078
PubChem CID:	104096642
Reduced:	NO5C15H21 (1)
Stoich.:	AB5C15D21 (1)
Weight, g/mol:	309.020414
ΔH_f, kcal/mol:	-200.29
Dipole, Da:	5.2
IP(EA), eV:	-8.81(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(2-chloro-4-nitrophenyl)methoxy]-3-fluorobenzaldehyde

Drug info:

PubChemData

Smile

CC(CCC(=O)NC1=CC(=CC=C1)OCC(=O)OC)OC

DOS

IR

Vibrations