Geometry & MOs

Info

ID:	335523
PubChem CID:	127254385
Reduced:	N4O4H16C17 (1)
Stoich.:	A4B4C16D17 (1)
Weight, g/mol:	504.23727
ΔH_f, kcal/mol:	-83.13
Dipole, Da:	4.77
IP(EA), eV:	-8.75(-0.99)
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-[1-(2-methylpropyl)-2-oxoquinolin-3-yl]propanoate

Drug info:

PubChemData

Smile

COC1=CNC(=CC1=O)C(=O)NCCN2C=NC3=CC=CC=C3C2=O

DOS

IR

Vibrations