Geometry & MOs

Info

ID:	36978
PubChem CID:	8015605
Reduced:	SN3O5C20H23 (1)
Stoich.:	AB3C5D20E23 (1)
Weight, g/mol:	414.088557
ΔH_f, kcal/mol:	-147.33
Dipole, Da:	5.39
IP(EA), eV:	-9.11(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[[2-(furan-2-ylmethylcarbamoyl)phenyl]sulfamoyl]benzoate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NNC(=O)C1=CC=C(C=C1)NS(=O)(=O)/C=C/C2=CC=CC=C2

DOS

IR

Vibrations