Geometry & MOs

Info

ID:	295020
PubChem CID:	117511910
Reduced:	FNSO4C15H22 (1)
Stoich.:	ABCD4E15F22 (1)
Weight, g/mol:	331.178358
ΔH_f, kcal/mol:	-201.02
Dipole, Da:	4.99
IP(EA), eV:	-9.44(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-[(2-methylpropan-2-yl)oxycarbonyl]-3,4-dihydro-2H-quinolin-6-yl]cyclobutane-1-carboxylic acid

Drug info:

PubChemData

Smile

COC1=C(C(=C(C=C1C2(CCCCC2)N)F)S(=O)(=O)C)OC

DOS

IR

Vibrations