Geometry & MOs

Info

ID:	351298
PubChem CID:	127280186
Reduced:	O2N5C22H31 (1)
Stoich.:	A2B5C22D31 (1)
Weight, g/mol:	389.24269
ΔH_f, kcal/mol:	-52.31
Dipole, Da:	2.12
IP(EA), eV:	-8.47(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclohexyl-2-[4-(3,4-dimethyl-6-oxo-1H-pyridazine-5-carbonyl)piperazin-1-yl]-N-methylacetamide

Drug info:

PubChemData

Smile

CC1=CC2=NC(=CN2C=C1)C(=O)N3CCN(CC3)CC(=O)N(C)C4CCCCC4

DOS

IR

Vibrations