Geometry & MOs

Info

ID:	158
PubChem CID:	2204
Reduced:	N2O9C27H38 (1)
Stoich.:	A2B9C27D38 (1)
Weight, g/mol:	534.257731
ΔH_f, kcal/mol:	-406.71
Dipole, Da:	10.82
IP(EA), eV:	-8.79(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-[(3-formamido-2-hydroxybenzoyl)amino]-2,6-dimethyl-4,9-dioxo-8-pentyl-1,5-dioxonan-7-yl] 3-methylbutanoate

Drug info:

PubChemData

Smile

CCCCCC1C(C(OC(=O)C(C(OC1=O)C)NC(=O)C2=C(C(=CC=C2)NC=O)O)C)OC(=O)CC(C)C

DOS

IR

Vibrations