Geometry & MOs

Info

ID:	335900
PubChem CID:	127254762
Reduced:	OF3N6H13C15 (1)
Stoich.:	AB3C6D13E15 (1)
Weight, g/mol:	433.120462
ΔH_f, kcal/mol:	-82.73
Dipole, Da:	9.23
IP(EA), eV:	-9.51(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-(2-chloro-4-fluorophenyl)-3-[4-hydroxy-1-[2-(1H-imidazol-5-yl)ethyl]-6-methyl-2-oxopyridin-3-yl]propanoate

Drug info:

PubChemData

Smile

C1CN2C(=NN=C2C(F)(F)F)CN1CN3C(=O)C4=CC=CC=C4C=N3

DOS

IR

Vibrations