Geometry & MOs

Info

ID:	228393
PubChem CID:	87564184
Reduced:	FS2O3N8C24H25 (1)
Stoich.:	AB2C3D8E24F25 (1)
Weight, g/mol:	320.141245
ΔH_f, kcal/mol:	32.47
Dipole, Da:	5.91
IP(EA), eV:	-8.77(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[6-(4-propan-2-yloxyphenoxy)naphthalen-2-yl]acetaldehyde

Drug info:

PubChemData

Smile

C1CC1N2CCN(CC2)CC(=O)NC3=NC4=CC(=C(C=C4S3)SC5=NN=C6N5N=C(C=C6)OC7COC7)F

DOS

IR

Vibrations