Geometry & MOs

Info

ID:	185314
PubChem CID:	77285085
Reduced:	ClFO3N4C23H26 (1)
Stoich.:	ABC3D4E23F26 (1)
Weight, g/mol:	483.136112
ΔH_f, kcal/mol:	-84.51
Dipole, Da:	6.49
IP(EA), eV:	-7.98(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[6-amino-7-[1-(2-chloro-3-fluoro-6-methoxyphenyl)ethoxy]furo[3,2-c]pyridin-3-yl]-N,N-dimethylbenzamide

Drug info:

PubChemData

Smile

CC(C1=C(C=CC(=C1Cl)F)OC)OC2=C3C(=CN=C2N)C(=CO3)C4=CCN(CC4)CCN

DOS

IR

Vibrations