Geometry & MOs

Info

ID:	246738
PubChem CID:	103064757
Reduced:	ClOSN3C13H18 (1)
Stoich.:	ABCD3E13F18 (1)
Weight, g/mol:	264.129634
ΔH_f, kcal/mol:	-35.65
Dipole, Da:	5.0
IP(EA), eV:	-8.78(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(ethylamino)-3-methyl-N-(thiolan-3-yl)benzamide

Drug info:

PubChemData

Smile

CCCNC1=NC(=CC(=C1)C(=O)NC2CCSC2)Cl

DOS

IR

Vibrations