Geometry & MOs

Info

ID:	423453
PubChem CID:	135119525
Reduced:	ON5C17H21 (1)
Stoich.:	AB5C17D21 (1)
Weight, g/mol:	356.184841
ΔH_f, kcal/mol:	43.04
Dipole, Da:	8.52
IP(EA), eV:	-8.82(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(2-methylpropyl)-2-oxo-N-[(3R,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]-1H-pyrimidine-4-carboxamide

Drug info:

PubChemData

Smile

CN1C=CN=C1CCCN(C)C(=O)C2=NN(C3=CC=CC=C32)C

DOS

IR

Vibrations