Geometry & MOs

Info

ID:	348947
PubChem CID:	127274672
Reduced:	SN2O3C12H20 (1)
Stoich.:	AB2C3D12E20 (1)
Weight, g/mol:	364.145678
ΔH_f, kcal/mol:	-140.59
Dipole, Da:	4.19
IP(EA), eV:	-8.74(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-butanoyl-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-N-methyl-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

C1CCOC(C1)CSCC(=O)N2CCNC(=O)C2

DOS

IR

Vibrations