Geometry & MOs

Info

ID:	200356
PubChem CID:	79376477
Reduced:	O2N3C13H15 (1)
Stoich.:	A2B3C13D15 (1)
Weight, g/mol:	222.061612
ΔH_f, kcal/mol:	-42.93
Dipole, Da:	4.08
IP(EA), eV:	-9.36(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxy-6-methyl-3-(2,2,2-trifluoroethyl)pyrimidin-4-one

Drug info:

PubChemData

Smile

CC1=NC(=CC=C1)CN2C(=O)C=C(N=C2OC)C

DOS

IR

Vibrations