Geometry & MOs

Info

ID:	361338
PubChem CID:	127302533
Reduced:	SO2N4C19H24 (1)
Stoich.:	AB2C4D19E24 (1)
Weight, g/mol:	379.237211
ΔH_f, kcal/mol:	-14.21
Dipole, Da:	4.56
IP(EA), eV:	-8.89(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(2-cyclopropyl-6-methylpyrimidin-4-yl)piperazin-1-yl]-N-(2,6-dimethylphenyl)acetamide

Drug info:

PubChemData

Smile

CC1=CC(=NC(=N1)C2CC2)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

DOS

IR

Vibrations