Geometry & MOs

Info

ID:	40104
PubChem CID:	8143568
Reduced:	OS2N4C18H20 (1)
Stoich.:	AB2C4D18E20 (1)
Weight, g/mol:	203.069477
ΔH_f, kcal/mol:	70.35
Dipole, Da:	3.61
IP(EA), eV:	-8.11(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-cyano-N-(4-methylphenyl)-2-nitrosoacetamide

Drug info:

PubChemData

Smile

COC1=CC=CC=C1N2C(=NN(C2=S)CN3CCCC3)C4=CC=CS4

DOS

IR

Vibrations