Geometry & MOs

Info

ID:	146644
PubChem CID:	53723084
Reduced:	N3O3C7H7 (1)
Stoich.:	A3B3C7D7 (1)
Weight, g/mol:	432.154135
ΔH_f, kcal/mol:	-70.17
Dipole, Da:	5.86
IP(EA), eV:	-10.2(-1.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-acetamido-N,N-dibenzyl-2-ethylsulfanyl-2-[(S)-ethylsulfinyl]acetamide

Drug info:

PubChemData

Smile

CNC(=O)C1=NC=CN=C1C(=O)O

DOS

IR

Vibrations