Geometry & MOs

Info

ID:	131199
PubChem CID:	51173523
Reduced:	ClON6C16H21 (1)
Stoich.:	ABC6D16E21 (1)
Weight, g/mol:	291.174691
ΔH_f, kcal/mol:	45.19
Dipole, Da:	4.07
IP(EA), eV:	-8.97(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-cyano-3-methylbutan-2-yl)-2-[(4-fluorophenyl)methyl-methylamino]acetamide

Drug info:

PubChemData

Smile

CCN1CCN(CC1)C(=O)C(C)N2N=C(N=N2)C3=CC=C(C=C3)Cl

DOS

IR

Vibrations