Geometry & MOs

Info

ID:	44861
PubChem CID:	10506218
Reduced:	N3O8C27H29 (1)
Stoich.:	A3B8C27D29 (1)
Weight, g/mol:	523.141321
ΔH_f, kcal/mol:	-183.21
Dipole, Da:	8.48
IP(EA), eV:	-8.67(-1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[[2-(2-hydroxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]carbamoyl]phenyl]-3,4,5-trimethoxybenzamide

Drug info:

PubChemData

Smile

COC1=CC2=CC(=C(C(=C2C=C1OC)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OC)C(=O)N4CCN(CC4)CCO

DOS

IR

Vibrations