Geometry & MOs

Info

ID:	148841
PubChem CID:	53788510
Reduced:	O5C13H18 (1)
Stoich.:	A5B13C18 (1)
Weight, g/mol:	208.067034
ΔH_f, kcal/mol:	-149.45
Dipole, Da:	1.93
IP(EA), eV:	-10.01(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-ethylphenyl)-2-thionitrosoacetamide

Drug info:

PubChemData

Smile

CCCC1(COC1)COC(=O)C(=O)OCCC#C

DOS

IR

Vibrations