Geometry & MOs

Info

ID:	350428
PubChem CID:	127277790
Reduced:	SN3O3C19H25 (1)
Stoich.:	AB3C3D19E25 (1)
Weight, g/mol:	350.130028
ΔH_f, kcal/mol:	-111.7
Dipole, Da:	2.34
IP(EA), eV:	-9.24(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=C(C=C1)C(=O)N2CSCC2C(=O)N3CCNC(=O)C3

DOS

IR

Vibrations