Geometry & MOs

Info

ID:	2804
PubChem CID:	8594
Reduced:	NO3H13C18 (1)
Stoich.:	AB3C13D18 (1)
Weight, g/mol:	291.089543
ΔH_f, kcal/mol:	-58.37
Dipole, Da:	5.08
IP(EA), eV:	-8.59(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(naphthalen-1-ylcarbamoyl)benzoic acid

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=CC=C2NC(=O)C3=CC=CC=C3C(=O)O

DOS

IR

Vibrations