Geometry & MOs

Info

ID:	234050
PubChem CID:	92297620
Reduced:	NSO2C8H11 (1)
Stoich.:	ABC2D8E11 (1)
Weight, g/mol:	197.084064
ΔH_f, kcal/mol:	-20.12
Dipole, Da:	6.4
IP(EA), eV:	-8.81(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-naphthalen-1-yloxypropanenitrile

Drug info:

PubChemData

Smile

C[C@H](C#C)OC[C@@H]1CNC(=S)O1

DOS

IR

Vibrations