Geometry & MOs

Info

ID:	349530
PubChem CID:	127275417
Reduced:	SO2N4C17H28 (1)
Stoich.:	AB2C4D17E28 (1)
Weight, g/mol:	269.119798
ΔH_f, kcal/mol:	-66.25
Dipole, Da:	2.4
IP(EA), eV:	-8.69(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-methyl-1,4-oxazepane-4-carboxamide

Drug info:

PubChemData

Smile

CC1CCCN(C1)CC2=CSC(=N2)NC(=O)N3CCCOC(C3)C

DOS

IR

Vibrations