Geometry & MOs

Info

ID:	236274
PubChem CID:	92712171
Reduced:	SF2O2N4H18C25 (1)
Stoich.:	AB2C2D4E18F25 (1)
Weight, g/mol:	488.107375
ΔH_f, kcal/mol:	-58.43
Dipole, Da:	4.95
IP(EA), eV:	-9.14(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[(2S)-2-benzyl-3-oxo-2H-imidazo[1,2-c]quinazolin-5-yl]sulfanyl]-N-[(4-chlorophenyl)methyl]acetamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C[C@H]2C(=O)N3C(=N2)C4=CC=CC=C4N=C3SCC(=O)NC5=C(C=CC(=C5)F)F

DOS

IR

Vibrations