Geometry & MOs

Info

ID:	364298
PubChem CID:	127315397
Reduced:	O2N4C19H30 (1)
Stoich.:	A2B4C19D30 (1)
Weight, g/mol:	346.236876
ΔH_f, kcal/mol:	-77.8
Dipole, Da:	4.69
IP(EA), eV:	-8.01(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-methylcyclohexyl)oxy-N-[6-(4-methylpiperazin-1-yl)pyridin-3-yl]acetamide

Drug info:

PubChemData

Smile

CCC(C(=O)NC1=CN=C(C=C1)N2CCN(CC2)C)OC3CCCC3

DOS

IR

Vibrations