Geometry & MOs

Info

ID:	149107
PubChem CID:	53788779
Reduced:	NO5C19H19 (1)
Stoich.:	AB5C19D19 (1)
Weight, g/mol:	362.24571
ΔH_f, kcal/mol:	-131.4
Dipole, Da:	2.28
IP(EA), eV:	-9.57(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-phenylhexadecanedioic acid

Drug info:

PubChemData

Smile

COC(=O)C=CCC1C2CC=C(N2C1=O)C(=O)OCC3=CC=CC=C3

DOS

IR

Vibrations