Geometry & MOs

Info

ID:	226999
PubChem CID:	87559522
Reduced:	SO8C28H54 (1)
Stoich.:	AB8C28D54 (1)
Weight, g/mol:	192.053492
ΔH_f, kcal/mol:	-442.03
Dipole, Da:	3.79
IP(EA), eV:	-10.74(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-3,5-diformylbenzamide

Drug info:

PubChemData

Smile

CCCCCCCCCCCC/C(=C(/CCCCCCCCCCCC)\C(=O)O)/C(=O)O.OS(=O)(=O)O

DOS

IR

Vibrations