Geometry & MOs

Info

ID:	68093
PubChem CID:	46507743
Reduced:	SO3N5H29C30 (1)
Stoich.:	AB3C5D29E30 (1)
Weight, g/mol:	266.039295
ΔH_f, kcal/mol:	-1.47
Dipole, Da:	5.19
IP(EA), eV:	-8.21(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[6-[(4-chlorophenyl)methylsulfanyl]pyridazin-3-yl]hydrazine

Drug info:

PubChemData

Smile

CC1=CC(=C2C3=C(C(=NC=N3)N4CCC(CC4)C(=O)NC5=CC(=C(C=C5)OC)OC)SC2=N1)C6=CC=CC=C6

DOS

IR

Vibrations