Geometry & MOs

Info

ID:	126397
PubChem CID:	50963661
Reduced:	NOC4H6 (4)
Stoich.:	ABC4D6 (4)
Weight, g/mol:	359.140055
ΔH_f, kcal/mol:	-108.7
Dipole, Da:	6.28
IP(EA), eV:	-9.65(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[[2-(6-chloropyridin-3-yl)acetyl]amino]-2-methylphenyl]-2,2-dimethylpropanamide

Drug info:

PubChemData

Smile

COC(=O)C1=NN2CCCN(CC2=C1)C(=O)CCN3CCCCO3

DOS

IR

Vibrations