Geometry & MOs

Info

ID:	318456
PubChem CID:	126651429
Reduced:	ON7C19H27 (1)
Stoich.:	AB7C19D27 (1)
Weight, g/mol:	624.159861
ΔH_f, kcal/mol:	20.62
Dipole, Da:	2.6
IP(EA), eV:	-8.32(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[2-[4-[5-chloro-2-(2,2,2-trifluoroethoxy)phenyl]-5-methoxy-2-oxopyridin-1-yl]-3-(1,4-dioxan-2-yl)propanoyl]amino]-N-methylpyridine-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)(CN=C(N)N)CN1C(=NC2=C1C3=CC=CC=C3N=C2N)CCOC

DOS

IR

Vibrations