Geometry & MOs

Info

ID:	64683
PubChem CID:	29203849
Reduced:	FSN4O5H21C24 (1)
Stoich.:	ABC4D5E21F24 (1)
Weight, g/mol:	371.115107
ΔH_f, kcal/mol:	-107.8
Dipole, Da:	3.24
IP(EA), eV:	-8.8(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-[bis(2-methoxyethyl)amino]-2-oxoethyl]sulfanyl-3-nitrobenzamide

Drug info:

PubChemData

Smile

COC1=CC=CC=C1NS(=O)(=O)C2=CC=CC(=C2)NC(=O)CCC3=NC(=NO3)C4=CC=C(C=C4)F

DOS

IR

Vibrations