Geometry & MOs

Info

ID:	311324
PubChem CID:	126590477
Reduced:	N3C8H15 (1)
Stoich.:	A3B8C15 (1)
Weight, g/mol:	505.147156
ΔH_f, kcal/mol:	22.82
Dipole, Da:	4.96
IP(EA), eV:	-8.88(0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-fluoro-4-[2-[3-(morpholin-4-ylmethyl)phenyl]thieno[3,2-b]pyridin-7-yl]oxyphenyl]-3-oxopropanamide

Drug info:

PubChemData

Smile

CC1=CN(C=N1)CCN(C)C

DOS

IR

Vibrations