Geometry & MOs

Info

ID:	126269
PubChem CID:	50957990
Reduced:	SO2N5C14H21 (1)
Stoich.:	AB2C5D14E21 (1)
Weight, g/mol:	325.226646
ΔH_f, kcal/mol:	-37.09
Dipole, Da:	6.58
IP(EA), eV:	-8.93(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-6-propan-2-yl-N-[1-(pyridin-3-ylmethyl)piperidin-3-yl]pyrimidin-4-amine

Drug info:

PubChemData

Smile

CN(CCNC1=NC(=NC2=CC=CC=C21)CCN)S(=O)(=O)C

DOS

IR

Vibrations