Geometry & MOs

Info

ID:	207019
PubChem CID:	80333983
Reduced:	O2N3C15H23 (1)
Stoich.:	A2B3C15D23 (1)
Weight, g/mol:	301.099731
ΔH_f, kcal/mol:	-29.11
Dipole, Da:	3.15
IP(EA), eV:	-9.15(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[(3-carbamothioylphenyl)methyl-methylamino]pyridazine-3-carboxamide

Drug info:

PubChemData

Smile

CN(CCOCC1CC1)CC2=CC=C(C=C2)C(=O)NN

DOS

IR

Vibrations