Geometry & MOs

Info

ID:	363079
PubChem CID:	127310110
Reduced:	O3N5C20H23 (1)
Stoich.:	A3B5C20D23 (1)
Weight, g/mol:	333.143704
ΔH_f, kcal/mol:	-39.86
Dipole, Da:	4.02
IP(EA), eV:	-9.04(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[2-[(4-methylpyrazol-1-yl)methyl]morpholin-4-yl]-2-oxoethyl]pyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CC1=CN(N=C1)CC2CN(CCO2)C(=O)CC3=NN(C(=O)C4=CC=CC=C43)C

DOS

IR

Vibrations