Geometry & MOs

Info

ID:	290051
PubChem CID:	104403912
Reduced:	ON5C12H19 (1)
Stoich.:	AB5C12D19 (1)
Weight, g/mol:	293.221561
ΔH_f, kcal/mol:	-13.38
Dipole, Da:	1.53
IP(EA), eV:	-9.01(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-tert-butyl-2-[[6-methyl-2-(propylamino)pyrimidin-4-yl]amino]propanamide

Drug info:

PubChemData

Smile

CCC1=NC(=CC(=N1)NC(C)C(=O)NC2CC2)N

DOS

IR

Vibrations