Geometry & MOs

Info

ID:	175256
PubChem CID:	75873977
Reduced:	Br2N2O2C15H16 (1)
Stoich.:	A2B2C2D15E16 (1)
Weight, g/mol:	453.122212
ΔH_f, kcal/mol:	-51.51
Dipole, Da:	5.88
IP(EA), eV:	-9.05(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4-dichloro-N-[1-[[6-(2-methoxyethoxy)pyridin-3-yl]amino]-4-methyl-1-oxopentan-2-yl]benzamide

Drug info:

PubChemData

Smile

C1CC(N(C1)C(=O)C2CC2)C(=O)NC3=C(C=CC(=C3)Br)Br

DOS

IR

Vibrations