Geometry & MOs

Info

ID:	65403
PubChem CID:	29214862
Reduced:	OS2N3C14H21 (1)
Stoich.:	AB2C3D14E21 (1)
Weight, g/mol:	424.214427
ΔH_f, kcal/mol:	-1.69
Dipole, Da:	6.43
IP(EA), eV:	-8.39(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2S)-1-[2-(butylcarbamothioyl)-2-methylhydrazinyl]-3-methyl-1-oxobutan-2-yl]-3,5-dimethoxybenzamide

Drug info:

PubChemData

Smile

CCCCNC(=S)N(C)NC(=O)C1=CC2=C(S1)CCC2

DOS

IR

Vibrations