Geometry & MOs

Info

ID:	353390
PubChem CID:	127284766
Reduced:	SN3O3C20H27 (1)
Stoich.:	AB3C3D20E27 (1)
Weight, g/mol:	368.213364
ΔH_f, kcal/mol:	-97.36
Dipole, Da:	6.95
IP(EA), eV:	-8.7(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-oxo-1-[oxolan-2-ylmethyl(thiolan-3-yl)amino]propan-2-yl]cyclohexanecarboxamide

Drug info:

PubChemData

Smile

C1CC(OC1)CN(C2CCSC2)C(=O)C3=CC(=CC=C3)NC(=O)NC4CC4

DOS

IR

Vibrations