Geometry & MOs

Info

ID:	89392
PubChem CID:	49961397
Reduced:	S2N4O4H18C23 (1)
Stoich.:	A2B4C4D18E23 (1)
Weight, g/mol:	252.093249
ΔH_f, kcal/mol:	-19.18
Dipole, Da:	7.25
IP(EA), eV:	-8.64(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methoxyethylcarbamothioyl)-2-phenylacetamide

Drug info:

PubChemData

Smile

CC1=CC(=NO1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53

DOS

IR

Vibrations