Geometry & MOs

Info

ID:	38693
PubChem CID:	8137754
Reduced:	SN2O4C22H24 (1)
Stoich.:	AB2C4D22E24 (1)
Weight, g/mol:	350.104876
ΔH_f, kcal/mol:	-103.62
Dipole, Da:	3.26
IP(EA), eV:	-9.31(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopropyl-2-[[2-[(1,1-dioxo-1,2-benzothiazol-3-yl)-methylamino]acetyl]amino]acetamide

Drug info:

PubChemData

Smile

CN(CC(=O)NC1CC1)C(=O)COC(=O)[C@@H](C2=CC=CC=C2)SC3=CC=CC=C3

DOS

IR

Vibrations