Geometry & MOs

Info

ID:	227378
PubChem CID:	87561580
Reduced:	N2O3C19H30 (1)
Stoich.:	A2B3C19D30 (1)
Weight, g/mol:	670.127539
ΔH_f, kcal/mol:	-81.18
Dipole, Da:	4.91
IP(EA), eV:	-8.78(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[3-fluoro-2-[4-(2-pyridin-2-ylethoxy)phenyl]-4-thieno[3,2-b]pyridin-7-yloxyphenyl]carbamothioyl]-2-phenylacetamide;hydrochloride

Drug info:

PubChemData

Smile

CCC(C(C)CC1=CC2=C(C=C1)OOCCC2)NC(=O)C(C)CN

DOS

IR

Vibrations