Geometry & MOs

Info

ID:	334254
PubChem CID:	127252806
Reduced:	O2N4H20C25 (1)
Stoich.:	A2B4C20D25 (1)
Weight, g/mol:	471.20055
ΔH_f, kcal/mol:	16.45
Dipole, Da:	7.09
IP(EA), eV:	-8.3(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(=O)N1CC2=C(C1=O)C(C3=CN(C4=CC=CC(=C43)N2)C)C5=CC6=C(C=C5)N=CC=C6

DOS

IR

Vibrations