Geometry & MOs

Info

ID:	32849
PubChem CID:	7848912
Reduced:	FNSO5C15H18 (1)
Stoich.:	ABCD5E15F18 (1)
Weight, g/mol:	388.072907
ΔH_f, kcal/mol:	-233.21
Dipole, Da:	5.24
IP(EA), eV:	-9.85(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-(furan-2-ylmethyl)-2-(2-methoxy-2-oxoethyl)sulfanyl-4-oxoquinazoline-7-carboxylate

Drug info:

PubChemData

Smile

CN(CC(=O)O[C@@H]1CCCCC1=O)S(=O)(=O)C2=CC=C(C=C2)F

DOS

IR

Vibrations