Geometry & MOs

Info

ID:	193393
PubChem CID:	78387828
Reduced:	ClNOC10H12 (1)
Stoich.:	ABCD10E12 (1)
Weight, g/mol:	134.032757
ΔH_f, kcal/mol:	-28.66
Dipole, Da:	5.64
IP(EA), eV:	-8.26(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethoxycarbonylimino-hydroxy-oxidoazanium

Drug info:

PubChemData

Smile

CCC1=CC(=CC(=CNC)C1=O)Cl

DOS

IR

Vibrations