Geometry & MOs

Info

ID:	46823
PubChem CID:	10527611
Reduced:	Cl2F3N3S3H6O6C7 (1)
Stoich.:	A2B3C3D3E6F6G7 (1)
Weight, g/mol:	452.169585
ΔH_f, kcal/mol:	-359.56
Dipole, Da:	2.48
IP(EA), eV:	-10.18(-1.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 1-ethyl-2-methyl-5-[2-[(2E)-2-[(4-nitrophenyl)methylidene]hydrazinyl]-2-oxoethoxy]indole-3-carboxylate

Drug info:

PubChemData

Smile

C1=C(C(=C(C(=C1S(=O)(=O)N)Cl)Cl)NS(=O)(=O)C(F)(F)F)S(=O)(=O)N

DOS

IR

Vibrations