Geometry & MOs

Info

ID:	338508
PubChem CID:	127259200
Reduced:	ClN2O3H9C11 (1)
Stoich.:	AB2C3D9E11 (1)
Weight, g/mol:	174.07529
ΔH_f, kcal/mol:	-70.7
Dipole, Da:	3.22
IP(EA), eV:	-9.02(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2E)-2-[(carbamoylamino)hydrazinylidene]ethyl] acetate

Drug info:

PubChemData

Smile

CC(=O)OCOC1=C2C(=C(C=C1)Cl)N=CC=N2

DOS

IR

Vibrations