Geometry & MOs

Info

ID:	353369
PubChem CID:	127284745
Reduced:	O2S2N3C17H25 (1)
Stoich.:	A2B2C3D17E25 (1)
Weight, g/mol:	356.176979
ΔH_f, kcal/mol:	-75.2
Dipole, Da:	7.84
IP(EA), eV:	-8.41(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-morpholin-4-yl-4-oxo-N-(oxolan-2-ylmethyl)-N-(thiolan-3-yl)butanamide

Drug info:

PubChemData

Smile

CC1=CC(=NC(=N1)SCC(=O)N(CC2CCCO2)C3CCSC3)C

DOS

IR

Vibrations