Geometry & MOs

Info

ID:	319009
PubChem CID:	126654110
Reduced:	NO5C40H57 (1)
Stoich.:	AB5C40D57 (1)
Weight, g/mol:	531.164165
ΔH_f, kcal/mol:	-153.52
Dipole, Da:	4.75
IP(EA), eV:	-7.99(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-hydroxybenzamide;2-hydroxy-N-(2-hydroxybenzoyl)benzamide

Drug info:

PubChemData

Smile

CCCCCCCOC1=C(C=C(C=C1)/C=C/C(=O)CC(C)/C=C/C2=CC(=C(C=C2)OCCCCCCN/C=C\C=C/C)OC)OC

DOS

IR

Vibrations