Geometry & MOs

Info

ID:	189366
PubChem CID:	77845166
Reduced:	OS2F5N5H10C18 (1)
Stoich.:	AB2C5D5E10F18 (1)
Weight, g/mol:	590.335587
ΔH_f, kcal/mol:	-168.76
Dipole, Da:	2.9
IP(EA), eV:	-9.32(-1.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2,3-dimethyl-4-(2-methylidenebutanoyl)phenoxy]-N-[5-[[2-[2,3-dimethyl-4-(2-methylidenebutanoyl)phenoxy]acetyl]amino]pentyl]acetamide

Drug info:

PubChemData

Smile

CC1=NSC(=C1C(=O)NC2=CC(=C(C=C2)F)F)NC3=NC4=C(C=CN=C4S3)C(F)(F)F

DOS

IR

Vibrations