Geometry & MOs

Info

ID:	126234
PubChem CID:	50956287
Reduced:	O2N5C19H25 (1)
Stoich.:	A2B5C19D25 (1)
Weight, g/mol:	363.136511
ΔH_f, kcal/mol:	-10.71
Dipole, Da:	4.01
IP(EA), eV:	-8.8(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-methyl-1-[2-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)amino]ethylamino]-1-oxopropan-2-yl]thiophene-2-carboxamide

Drug info:

PubChemData

Smile

CN1CCN2CCN(CC2C1=O)CC3=NC=CN3C4=CC=C(C=C4)OC

DOS

IR

Vibrations