Geometry & MOs

Info

ID:	366103
PubChem CID:	127319464
Reduced:	N3O3S3C15H19 (1)
Stoich.:	A3B3C3D15E19 (1)
Weight, g/mol:	353.129694
ΔH_f, kcal/mol:	-99.09
Dipole, Da:	5.87
IP(EA), eV:	-8.7(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,1-dioxothian-3-yl)-4-(oxolan-2-ylmethoxy)benzamide

Drug info:

PubChemData

Smile

CC1=C(SC2=C1C(=NC=N2)SCC(=O)NC3CCCS(=O)(=O)C3)C

DOS

IR

Vibrations