Geometry & MOs

Info

ID:	38586
PubChem CID:	8137143
Reduced:	SN3O5C18H19 (1)
Stoich.:	AB3C5D18E19 (1)
Weight, g/mol:	346.030954
ΔH_f, kcal/mol:	-97.44
Dipole, Da:	2.25
IP(EA), eV:	-9.12(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopropyl-2-[[2-[(3,4-dichlorophenyl)methylsulfanyl]acetyl]amino]acetamide

Drug info:

PubChemData

Smile

CC1=CC(=NO1)OCC(=O)OCC(=O)N(C)[C@H](C)C2=NC3=CC=CC=C3S2

DOS

IR

Vibrations