Geometry & MOs

Info

ID:	336184
PubChem CID:	127255191
Reduced:	O3N4C19H26 (1)
Stoich.:	A3B4C19D26 (1)
Weight, g/mol:	477.06995
ΔH_f, kcal/mol:	-105.79
Dipole, Da:	2.74
IP(EA), eV:	-8.42(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CN(CC(=O)N1)C(=O)CCCC(=O)N2CCN(CC2)C3=CC=CC=C3

DOS

IR

Vibrations