Geometry & MOs

Info

ID:	261191
PubChem CID:	103221863
Reduced:	ClINOC17H17 (1)
Stoich.:	ABCDE17F17 (1)
Weight, g/mol:	269.152812
ΔH_f, kcal/mol:	2.42
Dipole, Da:	4.43
IP(EA), eV:	-9.66(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(cyclopropylmethylamino)-2-(2-phenylethyl)pyridazin-3-one

Drug info:

PubChemData

Smile

CC(C)(CNC(=O)C1=CC(=C(C=C1)I)Cl)C2=CC=CC=C2

DOS

IR

Vibrations