Geometry & MOs

Info

ID:	178387
PubChem CID:	76319934
Reduced:	SN3O3H21C22 (1)
Stoich.:	AB3C3D21E22 (1)
Weight, g/mol:	525.193357
ΔH_f, kcal/mol:	-25.03
Dipole, Da:	7.31
IP(EA), eV:	-8.59(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

diethyl 2,6-dimethyl-4-[4-[2-oxo-2-[(2E)-2-(1-thiophen-2-ylethylidene)hydrazinyl]ethoxy]phenyl]-1,4-dihydropyridine-3,5-dicarboxylate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)[C@@H]2CC(=NN2C3=CC=C(C=C3)S(=O)(=O)N)C4=CC(=CC=C4)O

DOS

IR

Vibrations