Geometry & MOs

Info

ID:	369749
PubChem CID:	127335198
Reduced:	O2N5C21H33 (1)
Stoich.:	A2B5C21D33 (1)
Weight, g/mol:	330.241962
ΔH_f, kcal/mol:	-89.4
Dipole, Da:	5.77
IP(EA), eV:	-8.49(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-methylcyclohexyl)-N-[1-(6-methylpyridazin-3-yl)piperidin-3-yl]acetamide

Drug info:

PubChemData

Smile

CC1=NN=C(C=C1)N2CCCC(C2)NC(=O)C(C)NC(=O)CC3CCCCC3

DOS

IR

Vibrations