Geometry & MOs

Info

ID:	436565
PubChem CID:	135205447
Reduced:	S2N3O4C17H17 (1)
Stoich.:	A2B3C4D17E17 (1)
Weight, g/mol:	565.132838
ΔH_f, kcal/mol:	-73.76
Dipole, Da:	8.3
IP(EA), eV:	-9.08(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[5-chloro-2-[5-(difluoromethyl)-1,2-oxazol-3-yl]phenyl]-5-methoxy-2-oxopyridin-1-yl]-N-quinoxalin-6-ylbutanamide

Drug info:

PubChemData

Smile

CC1(CC1)NS(=O)(=O)C2=CC3=C(C=C2)N(C(=O)N3C4=CC=C(S4)C=O)C

DOS

IR

Vibrations