Geometry & MOs

Info

ID:	335479
PubChem CID:	127254341
Reduced:	ClSN2O3C15H19 (1)
Stoich.:	ABC2D3E15F19 (1)
Weight, g/mol:	506.180149
ΔH_f, kcal/mol:	-102.6
Dipole, Da:	7.34
IP(EA), eV:	-9.1(-0.47)
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-(7-oxo-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinolin-8-yl)propanoate

Drug info:

PubChemData

Smile

C1CCS(=O)(=O)N(C1)C2=CC(=C(C=C2)C(=O)NCC3CC3)Cl

DOS

IR

Vibrations