Geometry & MOs

Info

ID:	280617
PubChem CID:	103850254
Reduced:	SN2C11H14 (1)
Stoich.:	AB2C11D14 (1)
Weight, g/mol:	265.153875
ΔH_f, kcal/mol:	43.64
Dipole, Da:	3.57
IP(EA), eV:	-8.91(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[(1-amino-3-methyl-1-oxobutan-2-yl)amino]-N-ethylpyridazine-3-carboxamide

Drug info:

PubChemData

Smile

CCC(C)CSC1=CC=CC(=N1)C#N

DOS

IR

Vibrations