Geometry & MOs

Info

ID:	236269
PubChem CID:	92712140
Reduced:	SO2F3N4H19C22 (1)
Stoich.:	AB2C3D4E19F22 (1)
Weight, g/mol:	426.091725
ΔH_f, kcal/mol:	-163.69
Dipole, Da:	3.14
IP(EA), eV:	-9.15(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-chlorophenyl)-2-[[(2R)-3-oxo-2-propan-2-yl-2H-imidazo[1,2-c]quinazolin-5-yl]sulfanyl]acetamide

Drug info:

PubChemData

Smile

CC(C)[C@@H]1C(=O)N2C(=N1)C3=CC=CC=C3N=C2SCC(=O)NC4=CC=CC=C4C(F)(F)F

DOS

IR

Vibrations