Geometry & MOs

Info

ID:	372314
PubChem CID:	131296129
Reduced:	ClO2N3C10H10 (1)
Stoich.:	AB2C3D10E10 (1)
Weight, g/mol:	217.025419
ΔH_f, kcal/mol:	10.77
Dipole, Da:	6.28
IP(EA), eV:	-8.9(-1.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl N-(6-chloro-2-hydroxypyridazin-3-ylidene)carbamate

Drug info:

PubChemData

Smile

CC1=CC=C(C(=O)C1=C2NOC(=N2)CN)Cl

DOS

IR

Vibrations