Geometry & MOs

Info

ID:	230948
PubChem CID:	87572309
Reduced:	O3C6H10 (1)
Stoich.:	A3B6C10 (1)
Weight, g/mol:	669.141499
ΔH_f, kcal/mol:	-141.26
Dipole, Da:	4.08
IP(EA), eV:	-10.35(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-[4-(azetidine-1-carbonyl)phenoxy]-1,3-thiazol-2-yl]-2-(2,4-difluorophenoxy)-2-[4-(oxan-4-ylsulfonyl)phenyl]acetamide

Drug info:

PubChemData

Smile

CC(CC(=O)C)OC=O

DOS

IR

Vibrations