Geometry & MOs

Info

ID:	31123
PubChem CID:	854659
Reduced:	ClNOH14C15 (1)
Stoich.:	ABCD14E15 (1)
Weight, g/mol:	288.147393
ΔH_f, kcal/mol:	-14.52
Dipole, Da:	4.61
IP(EA), eV:	-9.47(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (4R)-6-methyl-2-oxo-4-(2,4,6-trimethylphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(=O)NCC2=CC=C(C=C2)Cl

DOS

IR

Vibrations