Geometry & MOs

Info

ID:	280167
PubChem CID:	103847315
Reduced:	NSO3C13H23 (1)
Stoich.:	ABC3D13E23 (1)
Weight, g/mol:	290.108899
ΔH_f, kcal/mol:	-158.26
Dipole, Da:	3.99
IP(EA), eV:	-8.81(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-cyanophenyl)-2-(2-methyloxolan-3-yl)sulfanylpropanamide

Drug info:

PubChemData

Smile

CC1C(CCO1)SCC(=O)NC(C(C)C)C(=O)C

DOS

IR

Vibrations