Geometry & MOs

Info

ID:	60055
PubChem CID:	26675624
Reduced:	FSO2N3H20C23 (1)
Stoich.:	ABC2D3E20F23 (1)
Weight, g/mol:	423.105291
ΔH_f, kcal/mol:	-60.08
Dipole, Da:	1.25
IP(EA), eV:	-8.88(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[5-(4-fluorophenyl)-4-oxothieno[2,3-d]pyrimidin-3-yl]-N-[(4-methoxyphenyl)methyl]acetamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)C)NC(=O)CN2C=NC3=C(C2=O)C(=CS3)C4=CC=C(C=C4)F)C

DOS

IR

Vibrations