Geometry & MOs

Info

ID:	320370
PubChem CID:	126659914
Reduced:	SN3C26H41 (1)
Stoich.:	AB3C26D41 (1)
Weight, g/mol:	361.111422
ΔH_f, kcal/mol:	19.81
Dipole, Da:	1.88
IP(EA), eV:	-8.11(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-fluorophenyl)methyl 2-(furan-2-yl)-7-methylquinoline-4-carboxylate

Drug info:

PubChemData

Smile

CC/C=C(\C=C/C)/NCCN(CCCCC1CCC2=C(C1)C=CC(=C2)C=NCC)S

DOS

IR

Vibrations